SCHEMBL9464655

SCHEMBL9464655

O=c1c(Cc2cccc(Cl)c2)nc(-c2ccccc2)nn1CCN1CCOCC1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ AVPR1B P47901 5/20 0.47
▸ ADORA2A P29274 1/20 0.45
▸ ADORA1 P30542 1/20 0.45
▸ MAPT P10636 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ ADRA1A P35348 1/20 0.45
▸ HRH1 P35367 1/20 0.45
▸ ADRA1B P35368 1/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ LMNA P02545 1/20 0.45
▸ SMN1; SMN2 Q16637 3/20 0.44
▸ TSHR P16473 2/20 0.43
▸ POLB P06746 1/20 0.43
▸ SLC2A1 P11166 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ ALDH1A1 P00352 2/20 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
SCHEMBL9464598 0.95 SMN1; SMN2 (0.46) AVPR1BADORA2AADORA1MAPTKMT2A
SCHEMBL9465249 0.94 MAPT (0.49) AVPR1BADORA2AADORA1MAPTKMT2A
SCHEMBL9465734 0.92 ADRA1A (0.48) AVPR1BMAPTKMT2AADRA1AHRH1
SCHEMBL9465027 0.90 MAPT (0.54) ADORA2AMAPTSMN1; SMN2TSHRPOLB
SCHEMBL9465687 0.90 SMN1; SMN2 (0.50) AVPR1BMAPTKMT2AMEN1LMNA
SCHEMBL9465745 0.89 SLC2A1 (0.47) AVPR1BMAPTKMT2AMEN1TSHR
SCHEMBL9465008 0.89 MAPT (0.47) AVPR1BMAPTKMT2AADRA1AHRH1
SCHEMBL9464546 0.88 MAPT (0.47) AVPR1BMAPTKMT2ASMN1; SMN2TSHR
SCHEMBL9465081 0.88 MAPT (0.45) AVPR1BMAPTSMN1; SMN2TSHRPOLB
SCHEMBL9464952 0.86 MAPT (0.46) AVPR1BMAPTKMT2AADRA1AHRH1

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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