SCHEMBL15529211

SCHEMBL15529211

O=C(Oc1ccccc1Cc1ccccc1C(=O)O)c1ccccc1O

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.69
HSD17B10 Q99714 4/20 0.69
KDM4E B2RXH2 4/20 0.69
ALDH1A1 P00352 4/20 0.69
ALOX15 P16050 1/20 0.53
TSHR P16473 3/20 0.49
CA1 P00915 2/20 0.49
CA2 P00918 2/20 0.49
CA9 Q16790 2/20 0.49
HMGB1 P09429 2/20 0.49
NAPRT Q6XQN6 2/20 0.49
CA12 O43570 1/20 0.49
CA4 P22748 1/20 0.49
CA6 P23280 1/20 0.49
CA7 P43166 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
CA14 Q9ULX7 1/20 0.49
CYP2C9 P11712 2/20 0.48
HIF1A Q16665 1/20 0.48
LMNA P02545 2/20 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
SCHEMBL4901578 0.83 TSHR (0.54) HPGDHSD17B10KDM4EALDH1A1ALOX15
Salsalate SCHEMBL29362887 0.82 HSD17B10 (1.00) HPGDHSD17B10KDM4EALDH1A1ALOX15
Salsalate SCHEMBL15562 0.82 HSD17B10 (1.00) HPGDHSD17B10KDM4EALDH1A1ALOX15
Salsalate SCHEMBL2025628 0.82 HSD17B10 (1.00) HPGDHSD17B10KDM4EALDH1A1ALOX15
SCHEMBL8092427 0.82 HSD17B10 (0.64) HPGDHSD17B10KDM4EALDH1A1ALOX15
SCHEMBL16674880 0.81 HSD17B10 (0.63) HPGDHSD17B10KDM4EALDH1A1ALOX15
SCHEMBL9333909 0.81 HSD17B10 (0.63) HPGDHSD17B10KDM4EALDH1A1ALOX15
Salsalate SCHEMBL25177171 0.81 KDM4E (0.96) HPGDHSD17B10KDM4EALDH1A1ALOX15
Salsalate SCHEMBL9704557 0.81 HSD17B10 (0.96) HPGDHSD17B10KDM4EALDH1A1ALOX15
Salsalate SCHEMBL9624915 0.81 HSD17B10 (0.96) HPGDHSD17B10KDM4EALDH1A1ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2847563-A2 DUAL-FUNCTION HEAT INDICATOR AND METHOD OF MANUFACTURE Temptime Corporation (US) 2015-03-18 EP claimed
WO-2013170273-A2 DUAL-FUNCTION HEAT INDICATOR AND METHOD OF MANUFACTURE TEMPTIME CORPORATION (US) 2013-11-14 WO claimed