SCHEMBL8936736

SCHEMBL8936736

Oc1ccc(Cl)cc1Cn1cncn1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 8/20 0.53
BRD4 O60885 1/20 0.51
HIF1A Q16665 2/20 0.49
HTT P42858 2/20 0.49
MEN1 O00255 1/20 0.49
SLC22A1 O15245 1/20 0.49
USP2 O75604 1/20 0.49
LMNA P02545 1/20 0.49
HSP90AA1 P07900 1/20 0.49
CYP3A4 P08684 1/20 0.49
MAPT P10636 1/20 0.49
HSPD1 P10809 1/20 0.49
HSPA5 P11021 1/20 0.49
IDO1 P14902 1/20 0.49
HPGD P15428 1/20 0.49
ALOX15 P16050 1/20 0.49
ALOX12 P18054 1/20 0.49
CASP1 P29466 1/20 0.49
BLM P54132 1/20 0.49
HSPE1 P61604 1/20 0.49

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
SCHEMBL9202589 0.88 BRD4 (0.51) CYP19A1BRD4HTTMEN1KMT2A
SCHEMBL9202210 0.81 BRD4 (0.51) CYP19A1BRD4HTTLMNAHSP90AA1
SCHEMBL3158915 0.81 CYP19A1 (0.50) CYP19A1BRD4HTTHPGDKMT2A
SCHEMBL8936696 0.81 BRD4 (0.51) CYP19A1BRD4HIF1ACYP3A4SMN1; SMN2
SCHEMBL9202769 0.81 BRD4 (0.51) CYP19A1BRD4
SCHEMBL9747728 0.81 CCR1 (0.55) CYP19A1HTTMEN1LMNACYP3A4
SCHEMBL7445529 0.78 CCR1 (0.50) CYP19A1BRD4HTTMEN1LMNA
SCHEMBL8936757 0.78 BRD4 (0.48) CYP19A1BRD4HSP90AA1CYP3A4ALOX15
SCHEMBL9197402 0.78 CYP19A1 (0.56) CYP19A1BRD4MEN1MAPTKMT2A
SCHEMBL8936807 0.77 CYP19A1 (0.58) CYP19A1BRD4HSP90AA1MAPTKCNMA1

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
US-5587392-A THERAPY FOR ESTROGEN DEPENDENT DISEASES MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1996-12-24 US disclosed
EP-0684235-A1 Novel azolyl methyl phenyl derivatives having aromatase inhibitory activity MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1995-11-29 EP disclosed