SCHEMBL9524826

SCHEMBL9524826

Cc1cc(C)c2nnc(C(=O)Nc3ccccc3)c(O)c2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.47
LMNA P02545 3/20 0.44
ALDH1A1 P00352 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
MAPT P10636 2/20 0.44
HPGD P15428 2/20 0.44
POLB P06746 1/20 0.43
KMT2A Q03164 1/20 0.43
ELANE P08246 3/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
RIPK1 Q13546 1/20 0.41
ADORA3 P0DMS8 1/20 0.41
FLT3 P36888 2/20 0.40
HIF1A Q16665 1/20 0.40
MAP4K1 Q92918 1/20 0.40
CCNA2 P20248 1/20 0.40
CDK2 P24941 1/20 0.40
CCNA1 P78396 1/20 0.40
CYP2C9 P11712 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
SCHEMBL9525648 0.83 RIPK1 (0.47) NPC1RAB9ALMNAALDH1A1SMN1; SMN2
SCHEMBL9527385 0.81 MEN1 (0.52) LMNAALDH1A1MAPTHPGDPOLB
SCHEMBL9525587 0.81 ADORA3 (0.47) NPC1RAB9ASMN1; SMN2MAPTPOLB
SCHEMBL9524703 0.77 GPR27 (0.46) NPC1RAB9AALDH1A1SMN1; SMN2MAPT
SCHEMBL9527884 0.74 POLB (0.45) NPC1RAB9ASMN1; SMN2MAPTPOLB
SCHEMBL9524877 0.74 ADORA3 (0.56) RAB9ALMNASMN1; SMN2MAPTHPGD
SCHEMBL9525559 0.73 EGFR (0.41) LMNAALDH1A1SMN1; SMN2MAPTHPGD
SCHEMBL9524562 0.72 ADORA3 (0.59) NPC1RAB9ALMNASMN1; SMN2MAPT
SCHEMBL9524321 0.72 FLT3 (0.57) NPC1RAB9AALDH1A1SMN1; SMN2MAPT
SCHEMBL9525781 0.72 FLT3 (0.51) NPC1RAB9ALMNAALDH1A1SMN1; SMN2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0277791-B1 CINNOLINE-CARBOXAMIDES AND PROCESS FOR THEIR PREPARATION FARMITALIA CARLO ERBA S.r.l. (IT) 1993-06-02 EP disclosed
US-4826837-A IMMUNOMODULATORS FARMITALIA CARLO ERBA S.R.L. (IT) 1989-05-02 US disclosed
EP-0277791-A2 Cinnoline-carboxamides and process for their preparation FARMITALIA CARLO ERBA S.r.l. (IT) 1988-08-10 EP disclosed