SCHEMBL27587648

SCHEMBL27587648

Oc1cccc2c1[nH]c1cc(Br)ccc12

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 4/20 0.76
PIM3 Q86V86 2/20 0.47
CCNB2 O95067 3/20 0.46
CDK1 P06493 3/20 0.46
CCNB1 P14635 3/20 0.46
CDK5 Q00535 3/20 0.46
CDK5R1 Q15078 3/20 0.46
CCNB3 Q8WWL7 3/20 0.46
CCNT1 O60563 1/20 0.46
CCNE2 O96020 1/20 0.46
CDK4 P11802 1/20 0.46
EIF2AK2 P19525 1/20 0.46
CCNA2 P20248 1/20 0.46
CCND1 P24385 1/20 0.46
CCNE1 P24864 1/20 0.46
CDK2 P24941 1/20 0.46
CDK9 P50750 1/20 0.46
CAMK2B Q13554 1/20 0.46
CAMK2G Q13555 1/20 0.46
CAMK2D Q13557 1/20 0.46

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
SCHEMBL2324939 0.86 AR (1.00) ARPIM3CCNB2CDK1CCNB1
SCHEMBL27977982 0.82 AR (0.51) ARPIM3CCNB2CDK1CCNB1
SCHEMBL29755083 0.82 AR (0.51) ARPIM3CCNB2CDK1CCNB1
SCHEMBL11806866 0.82 AR (0.56) ARCDK5CDK5R1CDK4CCND1
SCHEMBL20434645 0.79 KIF11 (0.58) ARPIM3CDK4CCND1CAMK2B
SCHEMBL329557 0.77 AR (0.62) ARMEN1TP53CYP3A4MAPT
SCHEMBL14716762 0.76 KIF11 (0.68) ARPIM3CCNB2CDK1CCNB1
SCHEMBL29963214 0.76 KIF11 (0.68) ARPIM3CCNB2CDK1CCNB1
SCHEMBL10868611 0.76 AR (0.61) ARMEN1TP53CYP3A4MAPT
SCHEMBL28463756 0.76 AR (0.61) ARMEN1TP53CYP3A4MAPT

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
CN-1423637-A Novel substituted tricyclic compounds ASAHI CHEMICAL IND (JP) 2003-06-11 CN disclosed