SCHEMBL8044336

SCHEMBL8044336

CC(C)(C)c1cc(Cl)cc(-c2cc(Cl)ccc2O)c1O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR1H4 Q96RI1 2/20 0.43
▸ ALDH1A1 P00352 3/20 0.40
▸ CYP2C9 P11712 2/20 0.40
▸ HSD17B10 Q99714 2/20 0.40
▸ PIM1 P11309 2/20 0.40
▸ LMNA P02545 2/20 0.40
▸ HTT P42858 2/20 0.40
▸ TYR P14679 2/20 0.40
▸ ALOX15 P16050 2/20 0.40
▸ NR1I2 O75469 1/20 0.40
▸ MIF P14174 1/20 0.40
▸ NFE2L2 Q16236 1/20 0.40
▸ IDO1 P14902 5/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ HIF1A Q16665 1/20 0.40
▸ CA2 P00918 3/20 0.39
▸ CA1 P00915 2/20 0.39
▸ TSHR P16473 1/20 0.39
▸ EPHX2 P34913 1/20 0.39
▸ SMN1; SMN2 Q16637 3/20 0.38

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
SCHEMBL4879678 0.87 CA2 (0.50) ALDH1A1CYP2C9HSD17B10LMNAHTT
SCHEMBL768507 0.79 ALDH1A1 (0.61) NR1H4ALDH1A1CYP2C9HSD17B10LMNA
SCHEMBL47579 0.77 CA2 (0.64) ALDH1A1CYP2C9HSD17B10LMNAHTT
SCHEMBL6242615 0.77 HSD17B10 (0.62) ALDH1A1CYP2C9HSD17B10PIM1LMNA
SCHEMBL31093991 0.77 HSD17B10 (0.62) ALDH1A1CYP2C9HSD17B10PIM1LMNA
SCHEMBL9489100 0.77 HSD17B10 (0.43) ALDH1A1CYP2C9HSD17B10PIM1LMNA
SCHEMBL23079288 0.75 CA2 (0.50) ALDH1A1CYP2C9HSD17B10LMNAHTT
Methane SCHEMBL28042257 0.74 HSD17B10 (0.59) ALDH1A1CYP2C9HSD17B10PIM1LMNA
SCHEMBL11233686 0.74 ALDH1A1 (0.59) ALDH1A1CYP2C9HSD17B10LMNAHTT
SCHEMBL11317922 0.71 HSD17B10 (0.50) NR1H4ALDH1A1CYP2C9HSD17B10LMNA

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-0764878-B1 Photothermographic elements comprising hydroxamic acid developers IMATION CORP (US) 2000-05-24 — — EP claimed
EP-0764878-B1 Photothermographic elements comprising hydroxamic acid developers IMATION CORP (US) 2000-05-24 — — EP disclosed
EP-0764878-A1 Photothermographic elements comprising hydroxamic acid developers Imation Corp. (US) 1997-03-26 — — EP disclosed
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