SCHEMBL22201635

SCHEMBL22201635

c1cnc2cc(-c3ccncc3)nc(Nc3ccc4cc(-c5cc(-c6cc7ncccc7c(Nc7ccc8ncsc8c7)n6)ccn5)[nH]c4c3)c2c1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PRKD1 Q15139 1/20 0.46
SYK P43405 1/20 0.41
TGFBR1 P36897 2/20 0.41
PRKCH P24723 1/20 0.40
PRKCE Q02156 1/20 0.40
RIPK2 O43353 2/20 0.40
RIPK1 Q13546 2/20 0.39
IKBKB O14920 9/20 0.39
LRRK2 Q5S007 1/20 0.39
CHUK O15111 1/20 0.36
CDK5 Q00535 1/20 0.35
CDK5R1 Q15078 1/20 0.35
FGFR2 P21802 1/20 0.35
FLT3 P36888 1/20 0.35
EGFR P00533 1/20 0.35
KDR P35968 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
SCHEMBL22201641 0.81 RIPK2 (0.55) PRKD1SYKTGFBR1PRKCHPRKCE
SCHEMBL22201452 0.74 PRKCH (0.58) SYKTGFBR1PRKCHPRKCE
SCHEMBL22201469 0.73 FGFR2 (0.62) PRKD1SYKTGFBR1PRKCHPRKCE
SCHEMBL22201381 0.72 PRKCH (0.51) SYKTGFBR1PRKCHPRKCEFGFR2
SCHEMBL22201450 0.72 PRKCH (0.51) SYKTGFBR1PRKCHPRKCEFGFR2
SCHEMBL22201638 0.71 KMT2A (0.57) PRKD1SYKTGFBR1PRKCHPRKCE
SCHEMBL22201449 0.70 PRKCH (0.51) SYKPRKCHPRKCEFGFR2FLT3
SCHEMBL22201284 0.70 ABCG2 (0.54) PRKD1TGFBR1
SCHEMBL22201470 0.69 PRKCH (0.47) PRKD1SYKTGFBR1PRKCHPRKCE
SCHEMBL22201369 0.67 LMNA (0.63) SYKPRKCHPRKCEEGFR

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
WO-2020142748-A1 METHODS AND MATERIALS FOR INCREASING TRANSCRIPTION FACTOR EB POLYPEPTIDE LEVELS UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2020-07-09 WO disclosed