SCHEMBL11316330

SCHEMBL11316330

CC(O)COc1ccc(C(C)(C)c2ccc(OCC(O)CN(C)C)cc2)cc1

nearest known ligand 0.86

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HIF1A Q16665 2/20 0.86
▸ HTT P42858 1/20 0.86
▸ AR P10275 1/20 0.58
▸ ALDH1A1 P00352 2/20 0.53
▸ HPGD P15428 1/20 0.53
▸ KMT2A Q03164 1/20 0.47
▸ KDM4E B2RXH2 2/20 0.46
▸ LMNA P02545 2/20 0.46
▸ CDK4 P11802 6/20 0.45
▸ CDK2 P24941 2/20 0.43
▸ POLB P06746 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.42

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
SCHEMBL14085644 0.94 HIF1A (0.97) HIF1AHTTARALDH1A1HPGD
SCHEMBL13851882 0.88 HTT (0.65) HIF1AHTTARALDH1A1HPGD
SCHEMBL376300 0.86 HIF1A (0.61) HIF1AHTTARALDH1A1HPGD
SCHEMBL11316310 0.86 HIF1A (0.82) HIF1AHTTARALDH1A1HPGD
SCHEMBL13513144 0.85 AR (0.78) HIF1AHTTARALDH1A1KMT2A
SCHEMBL13513140 0.84 AR (0.76) HIF1AHTTARALDH1A1KMT2A
SCHEMBL19001584 0.82 HTT (0.58) HIF1AHTTARALDH1A1HPGD
SCHEMBL13513189 0.82 HTT (0.58) HIF1AHTTARALDH1A1KMT2A
SCHEMBL13513185 0.82 HTT (0.58) HIF1AHTTARALDH1A1KMT2A
SCHEMBL17702714 0.82 HIF1A (0.56) HIF1AHTTARALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120184645-A1 RESINOUS DISPERSIONS INCLUDING AN EPOXY AMINE ADDUCT FOR FLATTING AND RELATED ELECTRODEPOSITABLE COATING COMPOSITIONS PPG INDUSTRIES OHIO, INC. (US) 2012-07-19 — — US disclosed
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