SCHEMBL19624752

SCHEMBL19624752

Cc1nn(I)c2c(=O)[nH]nc(N)c12

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 2/20 0.34
KCNH2 Q12809 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL19533708 0.81 PARP1 (0.36) FGFR1KCNH2
SCHEMBL19544846 0.71 PARP1 (0.36) FGFR1
SCHEMBL19533293 0.67 JAK1 (0.36) FGFR1KCNH2
SCHEMBL19544911 0.66 PDPK1 (0.42) KDM4EALDH1A1
SCHEMBL23122495 0.65 PARP1 (0.39) KDM4EALDH1A1
SCHEMBL19533307 0.64 FGFR1 (0.39) FGFR1KCNH2KDM4EALDH1A1
SCHEMBL19533303 0.61 PRMT5 (0.33) FGFR1KCNH2ALDH1A1
SCHEMBL23121627 0.61 ALDH1A1 (0.35) KDM4EALDH1A1
SCHEMBL23122198 0.61 PARP1 (0.39) KDM4EALDH1A1
SCHEMBL19533304 0.60 JAK1 (0.34) FGFR1

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-3246317-A1 BTK INHIBITOR Hubei Bio-Pharmaceutical Industrial Technological Institute Inc. (CN) 2017-11-22 EP disclosed