SCHEMBL19336271

SCHEMBL19336271

CCc1ncc(Br)c(C)n1

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MBOAT4 Q96T53 2/20 0.31
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL26301903 0.81 KDM4E (0.33) MBOAT4NPC1RAB9AKMT2A
SCHEMBL12514788 0.80
SCHEMBL3055813 0.79 ALDH1A1 (0.39)
SCHEMBL19743756 0.78 MBOAT4 (0.32) MBOAT4
SCHEMBL19485490 0.77 KMT2A (0.36) KMT2A
SCHEMBL22282975 0.75 HSD11B1 (0.36) NPC1RAB9A
SCHEMBL28267941 0.74 UHRF1 (0.35)
SCHEMBL2115976 0.74 LMNA (0.33)
SCHEMBL12344269 0.74 RXRA (0.37)
SCHEMBL28759514 0.74 SMN1; SMN2 (0.43) KMT2A

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
EP-3216792-A1 LACTAM KINASE INHIBITORS Tavares, Francis Xavier (US) 2017-09-13 EP disclosed