Stearic Acid

Stearic Acid

SCHEMBL16229003

CCC(N)NC(=N)NC(=N)N.CCCCCCCCCCCCCCCCCC(=O)O

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

rplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Stearic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.47
PPARG P37231 7/20 0.47
PPARD Q03181 7/20 0.47
PPARA Q07869 7/20 0.47
HDAC11 Q96DB2 5/20 0.47
TSHR P16473 4/20 0.47
PTPN1 P18031 3/20 0.47
ALDH1A1 P00352 3/20 0.47
TLR2 O60603 2/20 0.47
TDP1 Q9NUW8 2/20 0.47
FABP4 P15090 2/20 0.47
KMT2A Q03164 2/20 0.47
FFAR1 O14842 2/20 0.47
FFAR4 Q5NUL3 2/20 0.47
ALOX15 P16050 2/20 0.47
HSD17B10 Q99714 2/20 0.47
SLC22A6 Q4U2R8 1/20 0.47
SLC22A8 Q8TCC7 1/20 0.47
MEN1 O00255 1/20 0.47
ESR1 P03372 1/20 0.47

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Octanoic Acid SCHEMBL27605584 0.82 GPR84 (0.65) GPR84PPARGPPARDPPARAHDAC11
Stearic Acid SCHEMBL15058500 0.82 GPR84 (0.65) GPR84PPARGPPARDPPARAHDAC11
Nonanoate SCHEMBL28606614 0.82 GPR84 (0.65) GPR84PPARGPPARDPPARAHDAC11
Octanoic Acid SCHEMBL28483577 0.79 GPR84 (0.61) GPR84PPARGPPARDPPARAHDAC11
Stearic Acid SCHEMBL2352469 0.77 PLA2G2A (0.51) GPR84PPARGPPARDPPARAHDAC11
Stearic Acid SCHEMBL30725643 0.75 GPR84 (0.65) GPR84PPARGPPARDPPARAHDAC11
Stearic Acid SCHEMBL2363167 0.75 PLA2G2A (0.49) GPR84PPARGPPARDPPARAHDAC11
Dodecanoate SCHEMBL10885528 0.75 GPR84 (0.77) GPR84PPARGPPARDPPARAHDAC11
Palmitic Acid SCHEMBL9442061 0.75 GPR84 (0.77) GPR84PPARGPPARDPPARAHDAC11
Stearic Acid SCHEMBL1143367 0.75 GPR84 (0.77) GPR84PPARGPPARDPPARAHDAC11

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109280306-B Preparation method of polymethacrylimide composite foam conductive wave-absorbing material 浙江中科恒泰新材料科技有限公司 2021-04-13 CN claimed
CN-108570207-B Preparation method of high-strength automobile new material 博兴融智科技创新发展有限公司 2020-12-15 CN claimed
CN-108869233-A A kind of small-sized pressure stabilizing long axis Fire Fighting Pumps using novel coolant 贝德科技有限公司 2018-11-23 CN claimed
EP-4007561-A1 PREVENTION AND REDUCTION OF CORNIFICATION DISORDERS AND RELATED COSMETIC AGENTS Merck Patent GmbH (DE) 2022-06-08 EP disclosed
CN-109280306-B Preparation method of polymethacrylimide composite foam conductive wave-absorbing material 浙江中科恒泰新材料科技有限公司 2021-04-13 CN disclosed
WO-2021018990-A1 PREVENTION AND REDUCTION OF CORNIFICATION DISORDERS AND RELATED COSMETIC AGENTS MERCK PATENT GMBH (DE) 2021-02-04 WO disclosed
US-10893675-B2 Powder formulation containing insect repellent MERCK PATENT GMBH (DE) 2021-01-19 US disclosed
CN-108570207-B Preparation method of high-strength automobile new material 博兴融智科技创新发展有限公司 2020-12-15 CN disclosed
CN-108485219-B Preparation method of bio-based wood-plastic composite new material 安徽中科达美新材料科技有限公司 2020-12-11 CN disclosed
US-20200030214-A1 USE OF COMPATIBLE SOLUTES MERCK PATENT GMBH (DE) 2020-01-30 US disclosed
CN-108869233-A A kind of small-sized pressure stabilizing long axis Fire Fighting Pumps using novel coolant 贝德科技有限公司 2018-11-23 CN disclosed
CN-104010525-B Cyclohexanol derivative as antibacterial anti-microbial active matter purposes 默克专利股份有限公司 2017-08-25 CN disclosed
US-9492364-B2 Use of cyclohexanol derivatives as antimicrobial active compounds MERCK PATENT GMBH (DE) 2016-11-15 US disclosed
US-20160326091-A1 USE OF CYCLOHEXANOL DERIVATIVES AS ANTIMICROBIAL ACTIVE COMPOUNDS MERCK PATENT GMBH (DE) 2016-11-10 US disclosed
US-9181161-B2 Use of dicyclohexylmethanol derivatives having antimicrobial properties MERCK PATENT GMBH (DE) 2015-11-10 US disclosed
US-20150118165-A1 USE OF CYCLOHEXANOL ETHERS HAVING ANTIMICROBIAL PROPERTIES MERCK PATENT GMBH (DE) 2015-04-30 US disclosed
US-20150118172-A1 USE OF DICYCLOHEXYLMETHANOL DERIVATIVES HAVING ANTIMICROBIAL PROPERTIES MERCK PATENT GMBH (DE) 2015-04-30 US disclosed
CN-104487047-A Use of cyclohexanol ethers having antimicrobial properties MERCK PATENT GMBH 2015-04-01 CN disclosed
CN-104271109-A Use of dicyclohexylmethanol derivatives with antimicrobial properties MERCK PATENT GMBH 2015-01-07 CN disclosed
US-20140335029-A1 USE OF CYCLOHEXANOL DERIVATIVES AS ANTIMICROBIAL ACTIVE COMPOUNDS MERCK PATENT GMBH (DE) 2014-11-13 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20200030214-A1 USE OF COMPATIBLE SOLUTES SLC9A5, SLC9A1, SLC9A3 GPR84 3990/4885PPARG 4309/4885PPARD 4509/4885
US-20140335029-A1 USE OF CYCLOHEXANOL DERIVATIVES AS ANTIMICROBIAL ACTIVE COMPOUNDS CYP51A1, DDT, EBP GPR84 3959/4885PPARG 527/4885PPARD 194/4885
US-20150118172-A1 USE OF DICYCLOHEXYLMETHANOL DERIVATIVES HAVING ANTIMICROBIAL PROPERTIES DDT, DEK, EBP GPR84 4431/4885PPARG 291/4885PPARD 133/4885
US-20150118165-A1 USE OF CYCLOHEXANOL ETHERS HAVING ANTIMICROBIAL PROPERTIES EBP, CYP51A1, DECR2 GPR84 3350/4885PPARG 154/4885PPARD 36/4885
US-10893675-B2 Powder formulation containing insect repellent WAPL, ACHE, BPHL GPR84 2774/4885PPARG 4351/4885PPARD 4502/4885
US-20160326091-A1 USE OF CYCLOHEXANOL DERIVATIVES AS ANTIMICROBIAL ACTIVE COMPOUNDS CYP51A1, DDT, EBP GPR84 3959/4885PPARG 527/4885PPARD 194/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.