SCHEMBL10851597

SCHEMBL10851597

Cc1cccc(C=C2CCn3c2nc2cc(NC(=O)/C(Cl)=C(/Cl)C(=O)O)ccc2c3=O)c1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 8/20 0.54
▸ KMT2A Q03164 8/20 0.54
▸ NME2 P22392 1/20 0.50
▸ RAB9A P51151 2/20 0.49
▸ KDM4E B2RXH2 1/20 0.49
▸ MAPT P10636 1/20 0.49
▸ ALDH1A1 P00352 1/20 0.47
▸ POLB P06746 1/20 0.47
▸ THRB P10828 1/20 0.47
▸ HPGD P15428 1/20 0.47
▸ TDP1 Q9NUW8 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ NPC1 O15118 1/20 0.47
▸ ALOX5 P09917 1/20 0.47

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
SCHEMBL10851593 1.00 MEN1 (0.54) MEN1KMT2ANME2RAB9AKDM4E
SCHEMBL10851603 1.00 MEN1 (0.54) MEN1KMT2ANME2RAB9AKDM4E
SCHEMBL10853641 0.92 MEN1 (0.62) MEN1KMT2ANME2POLB
SCHEMBL10853628 0.92 MEN1 (0.62) MEN1KMT2ANME2POLB
SCHEMBL10853654 0.92 MEN1 (0.62) MEN1KMT2ANME2POLB
SCHEMBL10857187 0.92 MEN1 (0.54) MEN1KMT2ANME2ALOX5
SCHEMBL10857181 0.92 MEN1 (0.54) MEN1KMT2ANME2ALOX5
SCHEMBL10857176 0.92 MEN1 (0.54) MEN1KMT2ANME2ALOX5
SCHEMBL10857806 0.92 MEN1 (0.56) MEN1KMT2ANME2RAB9AKDM4E
SCHEMBL10857809 0.92 MEN1 (0.56) MEN1KMT2ANME2RAB9AKDM4E

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-4579847-A Amino derivatives of benzylidene-pyrrolo[2,1-b]quinazolines useful for treating conditions of allergic origin FARMITALIA CARLO ERBA S.P.A. (IT) 1986-04-01 — — US disclosed
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