SCHEMBL9352993

SCHEMBL9352993

C=CCc1ccc(Oc2ccc(Oc3ccc(CC=C)cc3)cc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.68
▸ CYP3A4 P08684 3/20 0.68
▸ SMN1; SMN2 Q16637 3/20 0.68
▸ TP53 P04637 2/20 0.68
▸ TSHR P16473 2/20 0.68
▸ ALOX15 P16050 1/20 0.68
▸ ALOX12 P18054 1/20 0.68
▸ XDH P47989 1/20 0.50
▸ MMP2 P08253 1/20 0.46
▸ PPARG P37231 2/20 0.45
▸ PPARD Q03181 2/20 0.45
▸ PPARA Q07869 1/20 0.45
▸ MAPT P10636 3/20 0.43
▸ GABRA1 P14867 2/20 0.43
▸ GABRB2 P47870 2/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ ALDH2 P05091 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ AKR1B1 P15121 1/20 0.43

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
SCHEMBL88416 1.00 ALDH1A1 (0.68) ALDH1A1CYP3A4SMN1; SMN2TP53TSHR
SCHEMBL3744646 0.98 ALDH1A1 (0.65) ALDH1A1CYP3A4SMN1; SMN2TP53TSHR
SCHEMBL2793675 0.98 ALDH1A1 (0.65) ALDH1A1CYP3A4SMN1; SMN2TP53TSHR
SCHEMBL5606838 0.91 TSHR (0.59) ALDH1A1CYP3A4SMN1; SMN2TP53TSHR
SCHEMBL19084220 0.89 SMN1; SMN2 (0.62) ALDH1A1CYP3A4SMN1; SMN2TP53TSHR
SCHEMBL9062160 0.89 ST14 (0.61) ALDH1A1CYP3A4SMN1; SMN2TP53TSHR
SCHEMBL9501888 0.89 ALDH1A1 (0.57) ALDH1A1CYP3A4SMN1; SMN2TP53TSHR
SCHEMBL15822354 0.86 ALDH1A1 (0.53) ALDH1A1CYP3A4SMN1; SMN2TP53TSHR
SCHEMBL437832 0.85 ALDH1A1 (0.68) ALDH1A1CYP3A4SMN1; SMN2TP53TSHR
SCHEMBL6669637 0.85 ALDH1A1 (0.57) ALDH1A1CYP3A4SMN1; SMN2TP53TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0367384-B1 Heat-sensitive recording material OJI PAPER CO (JP) 1994-09-21 — — EP claimed
US-4956332-A THERMOSENSITIVITY, MULTILAYER, COLOR DEVELOPERS, SUBSTRATES, LEUCO DYES OJI PAPER CO., LTD. (JP) 1990-09-11 — — US claimed
EP-0367384-A2 Heat-sensitive recording material OJI PAPER CO. LTD. (JP) 1990-05-09 — — EP claimed
EP-0367384-B1 Heat-sensitive recording material OJI PAPER CO (JP) 1994-09-21 — — EP disclosed
US-4956332-A THERMOSENSITIVITY, MULTILAYER, COLOR DEVELOPERS, SUBSTRATES, LEUCO DYES OJI PAPER CO., LTD. (JP) 1990-09-11 — — US disclosed
EP-0367384-A2 Heat-sensitive recording material OJI PAPER CO. LTD. (JP) 1990-05-09 — — EP disclosed
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