SCHEMBL17847929

SCHEMBL17847929

N#CCc1cc(F)ncn1

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.35
MAPT P10636 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL3672767 0.84 MEN1 (0.41) MEN1MAPTKMT2A
SCHEMBL24108440 0.75 KMO (0.39) MEN1MAPTKMT2A
SCHEMBL16447218 0.75 MEN1 (0.35) MEN1MAPTKMT2A
SCHEMBL25786468 0.75 MEN1 (0.35) MEN1MAPTKMT2A
SCHEMBL9970861 0.75 MEN1 (0.35) MEN1MAPTKMT2A
SCHEMBL24152409 0.75 CA2 (0.46) MEN1MAPTKMT2A
SCHEMBL24108549 0.72 CA2 (0.32) MEN1MAPTKMT2A
SCHEMBL24108557 0.72 CA2 (0.32) MEN1MAPTKMT2A
Water SCHEMBL9340500 0.71 LOXL2 (0.33)
Water SCHEMBL9340526 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3233787-A1 SUBSTITUTED 1,2,3-TRIYLIDENETRIS(CYANOMETHANYLYLIDENE)) CYCLOPROPANES FOR VTE, ELECTRONIC DEVICES AND SEMICONDUCTING MATERIALS USING THEM Novaled GmbH (DE) 2017-10-25 EP disclosed
WO-2016097017-A1 SUBSTITUTED 1,2,3-TRIYLIDENETRIS(CYANOMETHANYLYLIDENE)) CYCLOPROPANES FOR VTE, ELECTRONIC DEVICES AND SEMICONDUCTING MATERIALS USING THEM NOVALED GMBH (DE) 2016-06-23 WO disclosed