SCHEMBL9525892

SCHEMBL9525892

CCCCCCCNC(=O)c1nnc2ccccc2c1O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 4/20 0.52
USP2 O75604 1/20 0.51
HPGD P15428 4/20 0.48
MAPK1 P28482 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
ASAH1 Q13510 2/20 0.48
HTT P42858 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
KDM4E B2RXH2 2/20 0.47
ALDH1A1 P00352 2/20 0.47
GLA P06280 1/20 0.47
POLB P06746 1/20 0.47
GAA P10253 1/20 0.47
APOBEC3A P31941 1/20 0.47
ESR2 Q92731 1/20 0.47
CTDSP1 Q9GZU7 1/20 0.47
APOBEC3G Q9HC16 1/20 0.47
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46

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
SCHEMBL9525682 1.00 NAAA (0.52) NAAAUSP2HPGDMAPK1NPSR1
SCHEMBL9527401 0.95 TSHR (0.51) NAAAUSP2HPGDMAPK1NPSR1
SCHEMBL9524829 0.84 HTT (0.56) HPGDHTTKDM4EALDH1A1POLB
SCHEMBL9525642 0.81 KDM4E (0.51) HPGDMAPK1HTTL3MBTL1KDM4E
SCHEMBL9524590 0.81 RAD52 (0.49) HPGDMAPK1HTTKDM4EALDH1A1
SCHEMBL9523732 0.79 RAB9A (0.55) HTTL3MBTL1ALDH1A1GAANPC1
SCHEMBL11022308 0.79 NAAA (0.58) NAAAUSP2HPGDNPSR1ASAH1
SCHEMBL9525025 0.77 ALDH1A1 (0.44) ALDH1A1
SCHEMBL31372088 0.77 EGLN1 (0.62)
SCHEMBL821644 0.77 EGLN1 (0.62)

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