SCHEMBL8445562

SCHEMBL8445562

CCCCCCCCCCCCCCCCCC(=O)OC(=O)c1ccc(C(=O)O)cc1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.55
TSHR P16473 1/20 0.55
PLA2G4B P0C869 5/20 0.54
RARB P10826 8/20 0.51
MEN1 O00255 1/20 0.50
ALDH1A1 P00352 1/20 0.50
RARA P10276 1/20 0.50
MAPT P10636 1/20 0.50
MTOR P42345 1/20 0.50
KMT2A Q03164 1/20 0.50
PLA2G4A P47712 1/20 0.49
HTT P42858 1/20 0.48

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
SCHEMBL8446004 0.98 TP53 (0.54) TP53TSHRPLA2G4BRARBMEN1
SCHEMBL28102302 0.98 TP53 (0.53) TP53TSHRPLA2G4BRARBMEN1
SCHEMBL10772865 0.97 TP53 (0.53) TP53TSHRPLA2G4BRARBMEN1
SCHEMBL9016067 0.93 HSD17B3 (0.51) TSHRALDH1A1MAPT
SCHEMBL22655275 0.93 HSD17B3 (0.51) TSHRALDH1A1MAPT
SCHEMBL27726913 0.92 TSHR (0.46) TP53TSHRPLA2G4BRARBALDH1A1
SCHEMBL6841992 0.92 TSHR (0.46) TP53TSHRPLA2G4BRARBALDH1A1
SCHEMBL27788708 0.92 PPARG (0.50) TP53TSHRALDH1A1MAPTKMT2A
SCHEMBL3896406 0.90 TSHR (0.48) TP53TSHRPLA2G4BALDH1A1MAPT
Butyric Acid SCHEMBL28300359 0.89 ALDH1A1 (0.44) TP53TSHRPLA2G4BRARBMEN1

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
EP-0625564-B1 Lubricating oil INDIAN OIL CORP LTD (IN) 1999-01-13 EP disclosed
US-5387351-A Titanium alkoxide, carboxylic acid other than fatty acid, fatty acid, water in mineral or synthetic oil base INDIAN OIL CORPORATION (IN) 1995-02-07 US disclosed
EP-0625564-A1 Lubricating oil INDIAN OIL CORPORATION Ltd. (IN) 1994-11-23 EP disclosed