SCHEMBL1667668

SCHEMBL1667668

Cc1csc(C)c1-c1c(C(N)=O)c2cccnc2n1-c1ccc(O)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.39
HSP90AB1 P08238 1/20 0.39
USP14 P54578 1/20 0.37
PKMYT1 Q99640 5/20 0.34
REN P00797 5/20 0.34
EPHB3 P54753 2/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
EPHA3 P29320 1/20 0.33
WEE1 P30291 1/20 0.33
EPHB4 P54760 1/20 0.33
CREBBP Q92793 1/20 0.33
POLB P06746 1/20 0.33
PABPC1 P11940 1/20 0.33
AKT1 P31749 2/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32
HPGD P15428 1/20 0.32
CYP2C19 P33261 1/20 0.32

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
SCHEMBL1667743 0.88 USP14 (0.33) HSP90AA1HSP90AB1USP14REN
SCHEMBL1667744 0.88 USP14 (0.33) HSP90AA1HSP90AB1USP14REN
SCHEMBL1667747 0.84 USP14 (0.33) USP14RENALDH1A1
SCHEMBL1667693 0.80 HSP90AA1 (0.39) HSP90AA1HSP90AB1USP14RENMEN1
SCHEMBL12797301 0.75 HSP90AA1 (0.41) HSP90AA1HSP90AB1USP14RENMEN1
SCHEMBL1668112 0.72 HSP90AA1 (0.41) HSP90AA1HSP90AB1USP14RENAKT1
SCHEMBL1668111 0.72 HSP90AA1 (0.41) HSP90AA1HSP90AB1USP14RENAKT1
SCHEMBL1668113 0.72 HSP90AA1 (0.41) HSP90AA1HSP90AB1USP14RENAKT1
SCHEMBL12797222 0.69 BRD4 (0.38) HSP90AA1HSP90AB1USP14MEN1KMT2A
SCHEMBL1667699 0.68 BRD4 (0.36) HSP90AA1HSP90AB1USP14MEN1KMT2A

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
WO-2011042474-A1 NOVEL ESTROGEN RECEPTOR LIGANDS KARO BIO AB (SE) 2011-04-14 WO claimed