SCHEMBL29861884

SCHEMBL29861884

Cn1c(=O)c(N)cc2c(Cl)ncnc21

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 2/20 0.35
SRC P12931 2/20 0.35
FGFR1 P11362 1/20 0.35
FGFR2 P21802 1/20 0.35
FGFR4 P22455 1/20 0.35
FGFR3 P22607 1/20 0.35
CYP1A2 P05177 3/20 0.33
TSHR P16473 2/20 0.33
HSD17B10 Q99714 2/20 0.33
CYP2C9 P11712 1/20 0.33
SLC22A12 Q96S37 1/20 0.33
CYP3A4 P08684 1/20 0.33
CLK4 Q9HAZ1 1/20 0.33
PI4KA P42356 1/20 0.33
PI4K2B Q8TCG2 1/20 0.33
PI4K2A Q9BTU6 1/20 0.33
PI4KB Q9UBF8 1/20 0.33
USP2 O75604 1/20 0.33
LRRK2 Q5S007 1/20 0.33
HPGD P15428 1/20 0.33

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
SCHEMBL23326642 1.00 EGFR (0.35) EGFRSRCFGFR1FGFR2FGFR4
SCHEMBL29861403 0.81 HSD17B10 (0.33) CYP1A2TSHRHSD17B10CYP2C9SLC22A12
SCHEMBL23326744 0.81 HSD17B10 (0.33) CYP1A2TSHRHSD17B10CYP2C9SLC22A12
SCHEMBL24672007 0.81 SLC22A12 (0.39) SRCCYP1A2TSHRHSD17B10CYP2C9
SCHEMBL23326542 0.77 TLR7 (0.36) EGFRSRCFGFR1FGFR2FGFR4
SCHEMBL29910281 0.77 TLR7 (0.36) EGFRSRCFGFR1FGFR2FGFR4
SCHEMBL29861603 0.76 CYP1A2 (0.38) CYP1A2TSHRCYP2C9CYP3A4HPGD
SCHEMBL23326451 0.76 CYP1A2 (0.38) CYP1A2TSHRCYP2C9CYP3A4HPGD
SCHEMBL12410481 0.74 SELE (0.35) SRCHSD17B10SLC22A12PI4KAPI4K2B
SCHEMBL17148436 0.73 SELE (0.34) SRCSLC22A12PI4KAPI4K2BPI4K2A

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-4055017-A1 BICYCLIC HETEROARYL COMPOUNDS AND USES THEREOF Revolution Medicines, Inc. (US) 2022-09-14 EP disclosed
CN-114901662-A Bicyclic heteroaryl compounds and uses thereof 锐新医药公司 2022-08-12 CN disclosed