SCHEMBL695988

SCHEMBL695988

Cc1[c]cccc1-c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDCD1 Q15116 1/20 0.39
CD274 Q9NZQ7 1/20 0.39
ALDH1A1 P00352 5/20 0.39
HSD17B10 Q99714 2/20 0.39
CYP2A6 P11509 2/20 0.39
HPGD P15428 2/20 0.39
BCL2L1 Q07817 1/20 0.39
MAPK1 P28482 1/20 0.39
CYP2B6 P20813 1/20 0.39
PTGS2 P35354 1/20 0.36
AKT1 P31749 1/20 0.36
AKT2 P31751 1/20 0.36
ESR2 Q92731 1/20 0.36
BACE1 P56817 1/20 0.36
DPP4 P27487 1/20 0.35
SLC22A2 O15244 1/20 0.34
SLC22A1 O15245 1/20 0.34
SLC22A3 O75751 1/20 0.34
SLC6A4 P31645 1/20 0.34
HDAC4 P56524 1/20 0.34

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
SCHEMBL10623223 0.96 PTGS2 (0.38) PDCD1CD274ALDH1A1HSD17B10CYP2A6
SCHEMBL2565144 0.84 TDP1 (0.35) ALDH1A1HPGDMAPK1SMN1; SMN2MEN1
SCHEMBL7707290 0.83 ALDH1A1 (0.38) ALDH1A1MAPK1PTGS2SMN1; SMN2MEN1
SCHEMBL7700044 0.83 GSTP1 (0.49) PTGS2SMN1; SMN2NPC1TSHRRAB9A
SCHEMBL22115865 0.83
SCHEMBL2014605 0.81 PTGS2 (0.42) PTGS2SLC6A4
SCHEMBL7459931 0.81 ALDH1A1 (0.39) ALDH1A1HSD17B10MEN1KMT2ANPC1
SCHEMBL6823830 0.81 PTGS2 (0.42) ALDH1A1HSD17B10HPGDPTGS2SLC6A4
SCHEMBL8880561 0.81 MAPT (0.39) ALDH1A1HSD17B10MAPK1AKT1SMN1; SMN2
SCHEMBL3537988 0.79 ACHE (0.41) ALDH1A1HPGDSMN1; SMN2KMT2ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118108750-A Method for preparing homoallylsilane compound 中国科学院大连化学物理研究所 2024-05-31 CN claimed
CN-116102888-A Damping vibration-absorbing silicone rubber composition and preparation method thereof 安徽东爵有机硅有限公司 2023-05-12 CN claimed
US-10076517-B2 Methods and pharmaceutical compositions for the treatment of fibrosis INSERM (INSTITUT NATIONAL DE LA SANTÉ ET DE KA RECHERCHE MÉDICALE (FR) 2018-09-18 US claimed
JP-6008256-B2 ネピュレ株式会社 2016-10-19 JP claimed
CN-102459167-B Azetidinyl diamides as monoacylglycerol lipase inhibitors JANSSEN PHARMACEUTICA NV 2015-04-01 CN claimed
EP-2421825-B9 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2014-08-20 EP claimed
US-8691805-B2 Azetidinyl diamides as monoacylglycerol lipase inhibitors JANSSEN PHARMACEUTICA, NV (BE) 2014-04-08 US claimed
EP-2421825-B1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2014-01-01 EP claimed
US-20130244997-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS JANSSEN PHARMACEUTICA NV (US) 2013-09-19 US claimed
US-8530593-B2 Catalyst compounds and use thereof EXXONMOBIL CHEMICAL PATENTS INC. (US) 2013-09-10 US claimed
WO-1993001715-A1 1,4-DIARYL-1-CYCLOPROPYL-4-SUBSTITUTED BUTANES AS INSECTICIDES AND ACARICIDES FMC CORPORATION (US) 1993-02-04 WO claimed
EP-0357610-B1 INSECTICIDAL CYCLOPROPYL-SUBSTITUTED DI(ARYL) COMPOUNDS FMC Corporation (US) 1992-09-16 EP claimed
US-5118704-A Treating disorders of central nervous, cardiovascular and endocrine systems WHITBY RESEARCH, INC. (US) 1992-06-02 US claimed
EP-0211561-B1 INSECTICIDAL ETHERS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-03-11 EP claimed
EP-0357610-A1 INSECTICIDAL CYCLOPROPYL-SUBSTITUTED DI(ARYL) COMPOUNDS. FMC CORP (US) 1990-03-14 EP claimed
US-4898863-A Heterocyclic carboxamides ICI AMERICAS INC. (US) 1990-02-06 US claimed
US-4808762-A Insecticidal cyclopropyl-substituted di(aryl) compounds FMC CORPORATION (US) 1989-02-28 US claimed
WO-1988008416-A1 INSECTICIDAL CYCLOPROPYL-SUBSTITUTED DI(ARYL) COMPOUNDS FMC CORPORATION (US) 1988-11-03 WO claimed
EP-0269514-A2 Derivatives of 2,2-dimethylcyclopropanecarboxylic acid bearing a saturated halogenated chain at C-3, process and intermediates for their preparation, their use as pesticides and compositions containing them ROUSSEL-UCLAF (FR) 1988-06-01 EP claimed
EP-0211561-A1 Insecticidal ethers IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1987-02-25 EP claimed

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

For each of this compound's patents that has machine-readable text (2 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-10076517-B2 Methods and pharmaceutical compositions for the treatment of fibrosis LIPA, MGLL, PNLIP PDCD1 4839/4885CD274 4732/4885ALDH1A1 779/4885
US-20130244997-A1 AZETIDINYL DIAMIDES AS MONOACYLGLYCEROL LIPASE INHIBITORS PNLIP, LPL, LIPA PDCD1 3933/4885CD274 4756/4885ALDH1A1 364/4885

“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.