SCHEMBL9465249

SCHEMBL9465249

O=c1c(Cc2ccccc2)nc(-c2cccc(Cl)c2)nn1CCN1CCOCC1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ LMNA P02545 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ AVPR1B P47901 8/20 0.47
▸ SLC2A1 P11166 1/20 0.43
▸ ADORA2A P29274 2/20 0.43
▸ ADORA1 P30542 2/20 0.43
▸ ADRA1A P35348 1/20 0.41
▸ HRH1 P35367 1/20 0.41
▸ ADRA1B P35368 1/20 0.41

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
SCHEMBL9465687 0.95 SMN1; SMN2 (0.50) MAPTMEN1LMNAKMT2ASMN1; SMN2
SCHEMBL9464655 0.94 AVPR1B (0.47) MAPTMEN1LMNAKMT2ASMN1; SMN2
SCHEMBL9464952 0.92 MAPT (0.46) MAPTMEN1LMNAKMT2ASMN1; SMN2
SCHEMBL9465787 0.91 MAPT (0.45) MAPTMEN1LMNAKMT2ASMN1; SMN2
SCHEMBL9464945 0.91 MAPT (0.45) MAPTMEN1LMNAKMT2ASMN1; SMN2
SCHEMBL9464810 0.90 SIGMAR1 (0.50) MAPTLMNAADRA1AHRH1
SCHEMBL9464643 0.90 AVPR1B (0.46) MAPTMEN1LMNAKMT2AAVPR1B
SCHEMBL9465027 0.90 MAPT (0.54) MAPTSMN1; SMN2ADORA2A
SCHEMBL9464598 0.90 SMN1; SMN2 (0.46) MAPTMEN1LMNAKMT2ASMN1; SMN2
SCHEMBL9465008 0.89 MAPT (0.47) MAPTMEN1LMNAKMT2ASMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5254548-A Treating dysfunction of cholinergic system ADIR ET COMPAGNIE (FR) 1993-10-19 — — US disclosed
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