SCHEMBL6536227

SCHEMBL6536227

COC1=CC(Cl)(C=O)C(c2ccccc2)C=C1O

nearest known ligand 0.32

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 2/20 0.32
LMNA P02545 2/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
MAPT P10636 2/20 0.32
TP53 P04637 1/20 0.30
CYP3A4 P08684 1/20 0.30
HPGD P15428 1/20 0.30
ALOX15 P16050 1/20 0.30
ALOX12 P18054 1/20 0.30
MAPK1 P28482 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL6536248 0.82 CA1 (0.33) KDM4EALDH1A1LMNAMEN1KMT2A
SCHEMBL6535991 0.81 KDM4E (0.33) KDM4EALDH1A1LMNAMAPTTP53
SCHEMBL6536173 0.81 KDM4E (0.33) KDM4EALDH1A1LMNAMAPTTP53
SCHEMBL6536124 0.79 KDM4E (0.32) KDM4EALDH1A1LMNAMEN1KMT2A
SCHEMBL6536233 0.78 ADORA3 (0.32) ALDH1A1
SCHEMBL9558947 0.58 KDM1A (0.34) MEN1KMT2AMAPTCYP3A4
SCHEMBL4752286 0.55 POLB (0.31)
SCHEMBL8782024 0.54 TSHR (0.35) LMNAMEN1KMT2ACYP3A4HSD17B10
SCHEMBL23393891 0.54 CHRNA7 (0.44) ALDH1A1LMNAMEN1KMT2A
SCHEMBL8734945 0.53 MAPT (0.34) KDM4EALDH1A1LMNAMEN1KMT2A

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-1425015-A4 TETRAHYDROQUINOLINE DERIVATIVES AS ANTITHROMBOTIC AGENTS BRISTOL MYERS SQUIBB CO (US) 2004-12-15 EP disclosed
EP-1425015-A2 TETRAHYDROQUINOLINE DERIVATIVES AS ANTITHROMBOTIC AGENTS BRISTOL-MYERS SQUIBB COMPANY (US) 2004-06-09 EP disclosed
WO-2003015715-A2 TETRAHYDROQUINOLINE DERIVATIVES AS ANTITHROMBOTIC AGENTS BRISTOL-MYERS SQUIBB COMPANY (US) 2003-02-27 WO disclosed