SCHEMBL29640802

SCHEMBL29640802

Cn1cc(-c2ccc(N)cn2)cn1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 1/20 0.49
CYP11B2 P19099 1/20 0.49
AXL P30530 2/20 0.47
CHEK1 O14757 1/20 0.46
PIM1 P11309 3/20 0.44
MAPK1 P28482 1/20 0.44
FYN P06241 3/20 0.43
LRRK2 Q5S007 1/20 0.43
FGFR3 P22607 1/20 0.43
KDR P35968 1/20 0.43
MET P08581 1/20 0.43
MAPT P10636 3/20 0.43
ALOX5AP P20292 1/20 0.42
FEN1 P39748 1/20 0.42
USP30 Q70CQ3 1/20 0.42

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
SCHEMBL3386265 1.00 CYP11B1 (0.49) CYP11B1CYP11B2AXLCHEK1PIM1
SCHEMBL12858928 0.80 CYP11B1 (0.57) CYP11B1CYP11B2CHEK1PIM1MAPK1
SCHEMBL28363585 0.80 CYP11B1 (0.50) CYP11B1CYP11B2CHEK1PIM1MAPK1
SCHEMBL12897481 0.79 FYN (0.57) CYP11B1CYP11B2CHEK1PIM1MAPK1
SCHEMBL12594379 0.79 FGFR3 (0.57) CYP11B1CYP11B2CHEK1PIM1MAPK1
SCHEMBL15747733 0.79 CYP11B1 (0.49) CYP11B1CYP11B2AXLCHEK1PIM1
SCHEMBL16561338 0.79 MKNK1 (0.50) CYP11B1CYP11B2CHEK1PIM1MAPK1
SCHEMBL17121370 0.78 CYP11B1 (0.59) CYP11B1CYP11B2CHEK1PIM1MAPK1
SCHEMBL31375150 0.77 CCNC (0.58) AXLCHEK1PIM1MAPK1LRRK2
SCHEMBL3744510 0.77 AXL (0.51) AXLPIM1LRRK2KDRMET

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
CN-112218857-B P300/CBP HAT inhibitors and methods of use thereof 星座制药公司 2023-11-21 CN disclosed
CN-114450005-A Compounds for the treatment of neurological disorders 星座制药公司 2022-05-06 CN disclosed