SCHEMBL9524874

SCHEMBL9524874

CC(=O)Nc1ccc2nnc(C(=O)Nc3ccccc3)c(O)c2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 1/20 0.50
KMT2A Q03164 7/20 0.48
NPC1 O15118 7/20 0.48
RAB9A P51151 7/20 0.48
MAPT P10636 6/20 0.48
MEN1 O00255 4/20 0.48
KDM4E B2RXH2 3/20 0.48
PABPC1 P11940 1/20 0.48
NAPRT Q6XQN6 1/20 0.47
HSD17B10 Q99714 1/20 0.47
CACNA1B Q00975 1/20 0.47
APBA1 Q02410 1/20 0.47
POLB P06746 4/20 0.47
TAAR1 Q96RJ0 1/20 0.47
GAA P10253 2/20 0.44
SMN1; SMN2 Q16637 5/20 0.44
KDM1A O60341 1/20 0.44
MITF O75030 1/20 0.44
LMNA P02545 1/20 0.44
RAD52 P43351 1/20 0.44

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
SCHEMBL9524412 0.87 ADORA3 (0.54) ADORA3KMT2ANPC1RAB9AMAPT
SCHEMBL9527500 0.86 ABCG2 (0.51) ADORA3KMT2ANPC1RAB9AMAPT
SCHEMBL9527272 0.85 PTPN1 (0.50) KMT2ANPC1RAB9AMAPTMEN1
SCHEMBL9524642 0.85 KDM4E (0.45) KMT2ANPC1RAB9AMAPTMEN1
SCHEMBL9525587 0.85 ADORA3 (0.47) ADORA3KMT2ANPC1RAB9AMAPT
SCHEMBL9523845 0.84 LRRK2 (0.50) ADORA3KMT2ANPC1MAPTMEN1
SCHEMBL9524293 0.82 TP53 (0.46) ADORA3KMT2ANPC1RAB9AMEN1
SCHEMBL9525577 0.82 ADORA3 (0.49) ADORA3KMT2ANPC1RAB9AMAPT
SCHEMBL9524344 0.82 TMPRSS4 (0.51) ADORA3KMT2ANPC1RAB9AMEN1
SCHEMBL9524233 0.81 DHODH (0.54) ADORA3KMT2ANPC1RAB9AMAPT

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