SCHEMBL9465143

SCHEMBL9465143

Cc1nc(-c2ccccc2)n[nH]c1=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR1H2 P55055 7/20 0.53
▸ NR1H3 Q13133 7/20 0.53
▸ LMNA P02545 3/20 0.47
▸ RAB9A P51151 5/20 0.46
▸ SMN1; SMN2 Q16637 3/20 0.46
▸ POLB P06746 2/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ GLA P06280 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ NPSR1 Q6W5P4 2/20 0.46
▸ ATM Q13315 1/20 0.46
▸ NPC1 O15118 4/20 0.45
▸ HPGDS O60760 1/20 0.45
▸ DGAT1 O75907 1/20 0.45
▸ RXFP1 Q9HBX9 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ TP53 P04637 1/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ ALPL P05186 1/20 0.44
▸ CYP3A4 P08684 1/20 0.44

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
SCHEMBL9465116 0.82 NR1H2 (0.50) NR1H2NR1H3RAB9ASMN1; SMN2ALDH1A1
SCHEMBL9464804 0.77 NR1H2 (0.49) NR1H2NR1H3LMNARAB9ASMN1; SMN2
SCHEMBL1436121 0.76 NR1H2 (0.61) NR1H2NR1H3LMNARAB9ASMN1; SMN2
SCHEMBL9465535 0.73 NR1H2 (0.61) NR1H2NR1H3LMNARAB9APOLB
SCHEMBL17637927 0.72 AKT2 (0.63) LMNARAB9ASMN1; SMN2POLBALDH1A1
SCHEMBL10131903 0.70 AKT2 (0.61) LMNARAB9ASMN1; SMN2POLBALDH1A1
SCHEMBL666693 0.70 NR1H2 (1.00) NR1H2NR1H3LMNARAB9ASMN1; SMN2
SCHEMBL11480060 0.69 NPSR1 (0.63) LMNARAB9ASMN1; SMN2POLBALDH1A1
SCHEMBL11575048 0.69 NR1H2 (0.52) NR1H2NR1H3LMNARAB9ASMN1; SMN2
SCHEMBL28146139 0.69 NR1H2 (1.00) NR1H2NR1H3LMNARAB9ASMN1; 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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