SCHEMBL8303694

SCHEMBL8303694

Clc1cccc2c(CN3CC=C(C=Cc4ccccc4)CC3)n[nH]c12

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.46
DRD4 P21917 2/20 0.46
DRD3 P35462 2/20 0.46
KDM4E B2RXH2 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL8299061 1.00 DRD2 (0.46) DRD2DRD4DRD3KDM4ESMN1; SMN2
SCHEMBL8303352 0.84 DRD2 (0.49) DRD2DRD4DRD3KDM4ESMN1; SMN2
SCHEMBL8303355 0.84 DRD2 (0.49) DRD2DRD4DRD3KDM4ESMN1; SMN2
SCHEMBL8299419 0.78 DRD2 (0.38) DRD2DRD4DRD3KDM4EKMT2A
SCHEMBL8299074 0.77 PARP1 (0.46) DRD2DRD4DRD3
SCHEMBL8429503 0.75 KDM4E (0.64) DRD2DRD4DRD3KDM4ESMN1; SMN2
SCHEMBL8429501 0.75 KDM4E (0.64) DRD2DRD4DRD3KDM4ESMN1; SMN2
SCHEMBL8296824 0.74 CD44 (0.48) DRD2DRD4DRD3KDM4ESMN1; SMN2
Hydrochloric Acid SCHEMBL8428835 0.73 KDM4E (0.66) DRD2DRD4DRD3KDM4ESMN1; SMN2
Hydrochloric Acid SCHEMBL8428831 0.73 KDM4E (0.66) DRD2DRD4DRD3KDM4ESMN1; SMN2

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0701555-B1 INDAZOLE DERIVATIVES MERCK SHARP & DOHME (GB) 1999-08-04 EP claimed
EP-0701555-B1 INDAZOLE DERIVATIVES MERCK SHARP & DOHME (GB) 1999-08-04 EP disclosed
US-5665732-A Indazole derivatives MERCK, SHARP & DOHME LTD. (GB) 1997-09-09 US disclosed
EP-0701555-A1 INDAZOLE DERIVATIVES MERCK SHARP & DOHME LTD. (GB) 1996-03-20 EP disclosed
WO-1994021626-A1 INDAZOLE DERIVATIVES MERCK SHARP & DOHME LIMITED (GB) 1994-09-29 WO disclosed