SCHEMBL14724691

SCHEMBL14724691

CCCCNc1ncc2cc(Br)ccc2n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.44
ATM Q13315 1/20 0.44
CCNC P24863 1/20 0.43
HTT P42858 1/20 0.43
CDK8 P49336 1/20 0.43
FGFR1 P11362 2/20 0.41
EGFR P00533 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
TLR8 Q9NR97 1/20 0.40
FLT3 P36888 5/20 0.39
TYRO3 Q06418 5/20 0.39
MERTK Q12866 5/20 0.39
GAS6 Q14393 5/20 0.39
AXL P30530 2/20 0.39
HRH4 Q9H3N8 1/20 0.39
TRIM58 Q8NG06 1/20 0.39
DNM2 P50570 2/20 0.39
CRHBP P24387 1/20 0.38
CRHR2 Q13324 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38

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
SCHEMBL5498763 0.87 FGFR1 (0.53) KMT2AATMFGFR1EGFRFLT3
SCHEMBL5495588 0.86 FLT3 (0.47) KMT2AATMEGFRFLT3TRIM58
SCHEMBL5492795 0.86 KMT2A (0.56) KMT2AATMFGFR1L3MBTL1FLT3
SCHEMBL5496280 0.85 LMNA (0.44) KMT2AATMHTT
SCHEMBL5505032 0.83 EGFR (0.53) EGFRFLT3DNM2
SCHEMBL27857025 0.83 MERTK (0.45) FGFR1EGFRTLR8FLT3TYRO3
SCHEMBL27873830 0.82 EGFR (0.47) EGFRTLR8FLT3TYRO3MERTK
SCHEMBL5495483 0.82 BRAF (0.43)
SCHEMBL5494492 0.81 BRD4 (0.39) KMT2AATMCCNCHTTCDK8
SCHEMBL27857054 0.80 NPY1R (0.44) FGFR1EGFRTLR8FLT3TYRO3

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-1836174-B1 ARYL NITROGEN-CONTAINING BICYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS AMGEN INC (US) 2013-02-27 EP disclosed
CN-102491949-A Method for synthesizing 2-(N-alkyl) aminopyrimidine derivatives by means of N-alkylation UNIV NANJING SCIENCE & TECH 2012-06-13 CN disclosed