SCHEMBL9524522

SCHEMBL9524522

COc1ccccc1NC(=O)c1nnc2ccc(Cl)cc2c1O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.51
MAPT P10636 4/20 0.51
RAB9A P51151 2/20 0.51
NPC1 O15118 2/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
GRIK1 P39086 1/20 0.51
CTDSP1 Q9GZU7 1/20 0.49
KDM4E B2RXH2 3/20 0.49
HIF1A Q16665 2/20 0.49
KCNMA1 Q12791 1/20 0.49
HPGD P15428 3/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
TSHR P16473 1/20 0.47
HSD17B10 Q99714 1/20 0.47
MEN1 O00255 4/20 0.47
KMT2A Q03164 4/20 0.47
HTT P42858 2/20 0.47
TP53 P04637 2/20 0.47
LMNA P02545 1/20 0.47
GAA P10253 2/20 0.47

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
SCHEMBL9524160 0.86 HIF1A (0.57) ALDH1A1MAPTRAB9ANPC1L3MBTL1
SCHEMBL9524492 0.85 KCNMA1 (0.46) ALDH1A1MAPTRAB9ANPC1KDM4E
SCHEMBL9523476 0.85 MAPT (0.47) ALDH1A1MAPTRAB9ANPC1GRIK1
SCHEMBL9524714 0.81 NPC1 (0.56) ALDH1A1MAPTRAB9ANPC1GRIK1
SCHEMBL9523535 0.81 POLB (0.47) ALDH1A1MAPTRAB9ANPC1KCNMA1
SCHEMBL9524344 0.80 TMPRSS4 (0.51) ALDH1A1RAB9ANPC1GRIK1KDM4E
SCHEMBL9524532 0.77 S1PR4 (0.44) MAPTRAB9AKCNMA1SMN1; SMN2TSHR
SCHEMBL14567633 0.76 ALDH1A1 (0.59) ALDH1A1MAPTRAB9ANPC1L3MBTL1
SCHEMBL9524620 0.76 P2RX1 (0.52) ALDH1A1MAPTRAB9ANPC1HIF1A
SCHEMBL9525872 0.76 P2RX1 (0.50) ALDH1A1MAPTRAB9ANPC1HIF1A

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