Stearic Acid

Stearic Acid

SCHEMBL21989270

CCCCCCCCCCCCCCCCCC(=O)O.CNC(C)CCC=C(C)C

nearest known ligand 0.60

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
▸ ALDH1A1 P00352 3/20 0.57
▸ PPARG P37231 8/20 0.49
▸ PPARD Q03181 8/20 0.49
▸ PPARA Q07869 8/20 0.49
▸ PTPN1 P18031 5/20 0.49
▸ FABP4 P15090 4/20 0.49
▸ TERT O14746 3/20 0.49
▸ HSD17B10 Q99714 3/20 0.49
▸ TDP1 Q9NUW8 3/20 0.49
▸ MAPT P10636 2/20 0.49
▸ BLM P54132 2/20 0.49
▸ ALOX15 P16050 2/20 0.49
▸ FABP5 Q01469 2/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ GMNN O75496 1/20 0.49
▸ USP2 O75604 1/20 0.49
▸ LMNA P02545 1/20 0.49
▸ CYP1A2 P05177 1/20 0.49
▸ POLB P06746 1/20 0.49
▸ CYP2C9 P11712 1/20 0.49

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
Isometheptene SCHEMBL17316005 0.88 ALDH1A1 (0.71) ALDH1A1ALOX15ATMTSHR
Isometheptene SCHEMBL3927395 0.80 ALDH1A1 (0.73) ALDH1A1ALOX15USP2ATMTSHR
Stearic Acid SCHEMBL27481061 0.78 GPR84 (0.63) ALDH1A1PPARGPPARDPPARAPTPN1
Dexisometheptene SCHEMBL15894912 0.78 ALDH1A1 (0.68) ALDH1A1TDP1ALOX15KMT2AUSP2
Isometheptene SCHEMBL148619 0.78 ALDH1A1 (0.68) ALDH1A1TDP1ALOX15KMT2AUSP2
SCHEMBL11543742 0.76 TSHR (0.50) ALDH1A1PPARGPPARDPPARAPTPN1
Isometheptene SCHEMBL2820117 0.76 ALDH1A1 (0.66) ALDH1A1TDP1ALOX15KMT2AUSP2
Decanoic Acid SCHEMBL1833740 0.74 GPR84 (0.68) ALDH1A1PPARGPPARDPPARAPTPN1
Nonanoate SCHEMBL1830989 0.74 GPR84 (0.68) ALDH1A1PPARGPPARDPPARAPTPN1
Heptanoate SCHEMBL1839048 0.74 GPR84 (0.68) ALDH1A1PPARGPPARDPPARAPTPN1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11090237-B2 Deodorant cosmetic compositions comprising calcium silicate and sodium bicarbonate HENKEL AG & CO. KGAA (DE) 2021-08-17 — — US disclosed
US-20200170901-A1 DEODORANT COSMETIC COMPOSITIONS COMPRISING CALCIUM SILICATE AND SODIUM BICARBONATE HENKEL AG & CO. KGAA (DE) 2020-06-04 — — US disclosed
US-20200170896-A1 ANHYDROUS DEODORANT COSMETIC COMPOSITIONS COMPRISING CALCIUM CARBONATE HENKEL AG & CO. KGAA (DE) 2020-06-04 — — US disclosed
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