SCHEMBL11189873

SCHEMBL11189873

Nc1c[nH]c(-n2cccc2)n1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.31
▸ GAA P10253 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
SCHEMBL9848539 0.60 ALDH1A1 (0.51) NPC1RAB9AKDM4EGAA
SCHEMBL1662575 0.59 — —
SCHEMBL19619854 0.59 — —
SCHEMBL18078358 0.58 GRIN2D (0.43) NPC1RAB9AKDM4EGAA
Hydrochloric Acid SCHEMBL10696855 0.57 — —
SCHEMBL10099648 0.56 MAPK1 (0.42) NPC1RAB9AKDM4EGAA
SCHEMBL28047779 0.55 MAPT (0.50) NPC1RAB9AKDM4EGAA
SCHEMBL9466419 0.55 NPC1 (0.33) NPC1RAB9A
SCHEMBL1199229 0.55 — —
SCHEMBL19577698 0.55 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0009655-B1 6-AMINO SUBSTITUTED N-PYRROLYL-3-PYRIDAZINE AMINES, THEIR PREPARATION, AND PHARMACEUTICALLY ANTIHYPERTENSIVE COMPOSITIONS CONTAINING THEM GRUPPO LEPETIT S.P.A. (IT) 1983-05-11 — — EP disclosed
US-4247551-A N-Pyrrolyl-pyridazineamines and their use as antihypertensive agents GRUPPO LEPETIT S.P.A. (IT) 1981-01-27 — — US disclosed
EP-0009655-A1 6-Amino substituted N-pyrrolyl-3-pyridazine amines, their preparation, and pharmaceutically antihypertensive compositions containing them GRUPPO LEPETIT S.P.A. (IT) 1980-04-16 — — EP disclosed
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