SCHEMBL5178618

SCHEMBL5178618

CCc1c(-c2ccccc2)oc2ccccc2c1=O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABCG2 Q9UNQ0 2/20 0.60
▸ KDM4E B2RXH2 5/20 0.59
▸ KMT2A Q03164 4/20 0.59
▸ CYP3A4 P08684 4/20 0.59
▸ LMNA P02545 3/20 0.59
▸ MEN1 O00255 3/20 0.59
▸ TP53 P04637 2/20 0.59
▸ ALOX15 P16050 2/20 0.59
▸ MAPK1 P28482 2/20 0.59
▸ CA1 P00915 2/20 0.59
▸ CA2 P00918 2/20 0.59
▸ DDR2 Q16832 1/20 0.59
▸ CA12 O43570 1/20 0.59
▸ ABCB1 P08183 1/20 0.59
▸ CALM1 P0DP23 1/20 0.59
▸ AR P10275 1/20 0.59
▸ PKM P14618 1/20 0.59
▸ CYP1B1 Q16678 1/20 0.59
▸ CA9 Q16790 1/20 0.59
▸ ADORA3 P0DMS8 1/20 0.59

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
SCHEMBL31319016 1.00 ABCG2 (0.60) ABCG2KDM4EKMT2ACYP3A4LMNA
SCHEMBL18079061 0.84 KMT2A (0.59) ABCG2KDM4EKMT2ACYP3A4LMNA
SCHEMBL19846946 0.84 KMT2A (0.64) ABCG2KDM4EKMT2ACYP3A4LMNA
SCHEMBL19846957 0.84 DDR2 (0.64) ABCG2KDM4EKMT2ACYP3A4LMNA
SCHEMBL10800028 0.84 ABCG2 (0.54) ABCG2KDM4EKMT2ACYP3A4LMNA
SCHEMBL28788704 0.83 ABCG2 (0.56) ABCG2KDM4EKMT2ACYP3A4LMNA
SCHEMBL10800587 0.83 ABCG2 (0.52) ABCG2KDM4EKMT2ACYP3A4LMNA
SCHEMBL28788703 0.83 KDM4E (0.55) ABCG2KDM4EKMT2ACYP3A4LMNA
SCHEMBL13545615 0.83 ABCG2 (0.41) ABCG2KDM4EKMT2ACYP3A4LMNA
Hydrochloric Acid SCHEMBL28357397 0.83 DDR2 (0.62) ABCG2KDM4EKMT2ACYP3A4LMNA

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-1525177-B1 SUBSTITUTED 1,3-DIPHENYLPROP-2-EN-1-ONE DERIVATIVES, PREPARATION AND USES THEREOF GENFIT (FR) 2007-06-27 — — EP disclosed
EP-1519908-B1 COMPOSITION BASED ON SUBSTITUTED 1,3-DIPHENYLPROP-2-EN-1-ONE DERIVATIVES, PREPARATION AND USES THEREOF GENFIT (FR) 2007-06-13 — — EP disclosed
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