SCHEMBL24892249

SCHEMBL24892249

CCc1[nH]nc2cccnc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 4/20 0.38
ILK Q13418 1/20 0.37
HSP90AA1 P07900 2/20 0.35
NPC1 O15118 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
PRMT5 O14744 1/20 0.35
KDM4E B2RXH2 1/20 0.34
GMNN O75496 1/20 0.34
LMNA P02545 1/20 0.34
TP53 P04637 1/20 0.34
MMP2 P08253 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
MAPT P10636 1/20 0.34
MMP9 P14780 1/20 0.34
ALOX15 P16050 1/20 0.34
TSHR P16473 1/20 0.34
NFKB1 P19838 1/20 0.34
MMP8 P22894 1/20 0.34
CCR1 P32246 1/20 0.34

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
SCHEMBL15074585 0.75 HSP90AA1 (0.43) GRM4HSP90AA1NPC1L3MBTL1PRMT5
SCHEMBL19100788 0.74 POLB (0.43) GRM4NPC1EGFRTLR8TLR7
SCHEMBL2330553 0.71 MAPT (0.48) GRM4HSP90AA1NPC1L3MBTL1PRMT5
SCHEMBL19853487 0.71 CYP1A2 (0.50) ILKKDM4EMTORPBRM1ALDH1A1
SCHEMBL15070856 0.70 CCNB2 (0.39) GRM4HSP90AA1NPC1L3MBTL1PRMT5
SCHEMBL21672127 0.70 GRM4 (0.38) GRM4HSP90AA1NPC1L3MBTL1PRMT5
SCHEMBL29705608 0.67 GRM4 (0.50) GRM4
SCHEMBL15435736 0.67 GRM4 (0.50) GRM4
SCHEMBL18208663 0.66 KDM4E (0.40) GRM4L3MBTL1KDM4ELMNACYP3A4
SCHEMBL1311427 0.66 PARP1 (0.39) HSP90AA1KDM4EGMNNLMNATP53

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-2023287793-A1 THERAPEUTIC COMPOUNDS AND METHODS GENENTECH, INC. (US) 2023-01-19 WO disclosed