SCHEMBL8493156

SCHEMBL8493156

CC(C)(C)c1cc(=O)c2ccc(O)cc2o1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX15 P16050 2/20 0.66
▸ AKR1B1 P15121 4/20 0.55
▸ ALDH1A1 P00352 4/20 0.55
▸ MAOB P27338 3/20 0.55
▸ CYP3A4 P08684 3/20 0.55
▸ HPGD P15428 3/20 0.55
▸ KDM4E B2RXH2 3/20 0.55
▸ HSD17B10 Q99714 3/20 0.55
▸ CYP19A1 P11511 2/20 0.55
▸ MAOA P21397 2/20 0.55
▸ SMN1; SMN2 Q16637 2/20 0.55
▸ QPCT Q16769 2/20 0.55
▸ MPO P05164 1/20 0.55
▸ MAPK1 P28482 1/20 0.55
▸ IP6K2 Q9UHH9 1/20 0.55
▸ HSD17B3 P37058 3/20 0.53
▸ CA12 O43570 2/20 0.53
▸ CYP1A2 P05177 2/20 0.53
▸ CA9 Q16790 2/20 0.53
▸ AKR1B10 O60218 1/20 0.53

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
SCHEMBL14242734 0.87 AKR1B1 (0.53) ALOX15AKR1B1ALDH1A1MAOBCYP3A4
SCHEMBL7574697 0.87 ALOX15 (0.66) ALOX15ALDH1A1MAOBCYP3A4HPGD
SCHEMBL7372279 0.83 EPHX2 (0.61) ALOX15AKR1B1ALDH1A1MAOBCYP3A4
SCHEMBL25412346 0.80 ALOX15 (0.57) ALOX15AKR1B1ALDH1A1HPGDKDM4E
SCHEMBL3844782 0.78 ALOX15 (0.54) ALOX15ALDH1A1CYP3A4HPGDKDM4E
SCHEMBL29379868 0.77 HSD17B3 (0.61) ALOX15AKR1B1ALDH1A1MAOBCYP3A4
SCHEMBL1500217 0.77 HSD17B3 (0.61) ALOX15AKR1B1ALDH1A1MAOBCYP3A4
SCHEMBL12867892 0.77 ALOX15 (0.57) ALOX15ALDH1A1MAOBCYP3A4HPGD
SCHEMBL8782604 0.76 HPGD (0.60) ALOX15AKR1B1ALDH1A1MAOBCYP3A4
SCHEMBL22703864 0.75 HSD17B3 (0.51) AKR1B1ALDH1A1HPGDKDM4EHSD17B10

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
US-5977351-A Benzpyrylium squarylium and croconylium dyes, and processes for their preparation and use POLAROID CORPORATION (US) 1999-11-02 — — US disclosed
US-5627014-A COMPOSITIONS FOR ABSORBERS OF HEAT WHILE COLORING POLAROID CORPORATION (US) 1997-05-06 — — US disclosed
EP-0511381-B1 SQUARYLIUM AND CROCONYLIUM DYES POLAROID CORP (US) 1995-07-26 — — EP disclosed
US-5405976-A Infrared absorbers; solubility in solvents, polymers POLAROID CORPORATION (US) 1995-04-11 — — US disclosed
EP-0511381-A1 SQUARYLIUM AND CROCONYLIUM DYES. POLAROID CORP (US) 1992-11-04 — — EP disclosed
WO-1992009661-A1 SQUARYLIUM AND CROCONYLIUM DYES POLAROID CORPORATION (US) 1992-06-11 — — WO disclosed
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