SCHEMBL7652928

SCHEMBL7652928

CSc1cc(Cl)sc1C(=O)N[C@@H]1C2CCN(CC2)[C@H]1C

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 14/20 0.32
CHRNB2 P17787 9/20 0.32
CHRNA4 P43681 9/20 0.32
HTR3A P46098 2/20 0.32
EPHX2 P34913 1/20 0.31
HPGD P15428 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL7650292 0.85 CHRNA7 (0.36) CHRNA7CHRNB2CHRNA4HTR3A
SCHEMBL7062994 0.82 CHRNA7 (0.38) CHRNA7CHRNB2CHRNA4HTR3A
SCHEMBL7656286 0.82 ALDH1A1 (0.36) CHRNA7CHRNB2CHRNA4HTR3AHPGD
SCHEMBL7650658 0.78 F10 (0.39) CHRNA7CHRNB2CHRNA4HTR3A
SCHEMBL7063975 0.77 CHRNA7 (0.40) CHRNA7CHRNB2CHRNA4HTR3A
SCHEMBL7060781 0.75 KMT2A (0.47) CHRNA7CHRNB2CHRNA4HPGDSMN1; SMN2
SCHEMBL7653607 0.74 CHRNA7 (0.33) CHRNA7CHRNB2CHRNA4HTR3AHPGD
SCHEMBL7114554 0.74 CHRNA7 (0.38) CHRNA7CHRNB2CHRNA4
SCHEMBL6805064 0.73 CHRNA7 (0.43) CHRNA7CHRNB2CHRNA4HTR3A
SCHEMBL6829677 0.73 CHRNA7 (0.43) CHRNA7CHRNB2CHRNA4HTR3A

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
US-6492385-B2 CENTRAL NERVOUS SYSTEM DISORDERS PHARMACIA & UPJOHN COMPANY 2002-12-10 US claimed