SCHEMBL22201642

SCHEMBL22201642

c1cnc2cc(-c3ccncc3)nc(Nc3ccc4ncncc4c3)c2c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCH P24723 1/20 0.53
PRKCE Q02156 1/20 0.53
EGFR P00533 3/20 0.46
TGFBR1 P36897 1/20 0.44
SYK P43405 8/20 0.43
ERBB2 P04626 1/20 0.42
ERBB4 Q15303 1/20 0.42
HPGD P15428 3/20 0.42
LMNA P02545 2/20 0.42
MAPT P10636 1/20 0.42
ALDH1A1 P00352 2/20 0.40
POLB P06746 2/20 0.40
KDM4E B2RXH2 2/20 0.40
PDE5A O76074 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
GSK3A P49840 1/20 0.40
GSK3B P49841 1/20 0.40
FGFR2 P21802 1/20 0.40
FLT3 P36888 1/20 0.40
ABCB1 P08183 1/20 0.40

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
SCHEMBL22201452 0.85 PRKCH (0.58) PRKCHPRKCETGFBR1SYKHPGD
SCHEMBL22201561 0.81 HPGD (0.65) TGFBR1HPGDLMNAMAPTALDH1A1
SCHEMBL22201369 0.79 LMNA (0.63) PRKCHPRKCEEGFRSYKHPGD
SCHEMBL22201469 0.79 FGFR2 (0.62) PRKCHPRKCEEGFRTGFBR1SYK
SCHEMBL22201450 0.78 PRKCH (0.51) PRKCHPRKCEEGFRTGFBR1SYK
SCHEMBL22201634 0.78 TGFBR1 (0.54) PRKCHPRKCETGFBR1SYK
SCHEMBL22201637 0.78 PRKCH (0.50) PRKCHPRKCETGFBR1SYKHPGD
SCHEMBL22201638 0.78 KMT2A (0.57) PRKCHPRKCETGFBR1SYKHPGD
SCHEMBL22201641 0.77 RIPK2 (0.55) PRKCHPRKCEEGFRTGFBR1SYK
SCHEMBL22201381 0.76 PRKCH (0.51) PRKCHPRKCETGFBR1SYKHPGD

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