SCHEMBL11086320

SCHEMBL11086320

Nc1ccc2c(=O)n3c(nc2c1)C(=Cc1cccc(Cl)c1)CC3

nearest known ligand 0.73

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 6/20 0.73
▸ KMT2A Q03164 6/20 0.73
▸ POLB P06746 1/20 0.58
▸ RAB9A P51151 2/20 0.53
▸ NPC1 O15118 1/20 0.53
▸ KDM4E B2RXH2 1/20 0.49
▸ MAPT P10636 1/20 0.49
▸ ALOX5 P09917 1/20 0.49

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
SCHEMBL11086318 1.00 MEN1 (0.73) MEN1KMT2APOLBRAB9ANPC1
SCHEMBL11085731 0.94 MEN1 (0.64) MEN1KMT2APOLB
SCHEMBL11085732 0.94 MEN1 (0.64) MEN1KMT2APOLB
SCHEMBL11086567 0.92 MEN1 (0.64) MEN1KMT2APOLBRAB9ANPC1
SCHEMBL11086573 0.92 MEN1 (0.64) MEN1KMT2APOLBRAB9ANPC1
SCHEMBL11089833 0.89 MEN1 (0.61) MEN1KMT2APOLBRAB9ANPC1
SCHEMBL11089836 0.89 MEN1 (0.61) MEN1KMT2APOLBRAB9ANPC1
SCHEMBL11079429 0.89 MEN1 (0.63) MEN1KMT2APOLBRAB9ANPC1
SCHEMBL11079427 0.89 MEN1 (0.63) MEN1KMT2APOLBRAB9ANPC1
SCHEMBL10857514 0.89 MEN1 (0.60) MEN1KMT2ARAB9ANPC1KDM4E

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-4428952-A Substituted pyrrolo[2,1-b]quinazolines and pyrido[2,1-b]quinazolines useful for the treatment of or the prevention of gastrointestinal ulcers FARMITALIA CARLO ERBA S.P.A. (IT) 1984-01-31 — — US disclosed
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