SCHEMBL10377335

SCHEMBL10377335

CCOc1ccc(C(=O)c2ccc(=O)[nH]c2C=CN(C)C)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.47
▸ KDM4E B2RXH2 4/20 0.47
▸ MAPT P10636 4/20 0.47
▸ ALOX15 P16050 2/20 0.47
▸ HPGD P15428 2/20 0.47
▸ RECQL P46063 1/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ NPSR1 Q6W5P4 2/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ NPC1 O15118 3/20 0.41
▸ PLK1 P53350 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ MAOB P27338 4/20 0.40
▸ PARP10 Q53GL7 1/20 0.40
▸ RAB9A P51151 3/20 0.39
▸ TSHR P16473 1/20 0.39
▸ MAOA P21397 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL10377334 1.00 ALDH1A1 (0.47) ALDH1A1KDM4EMAPTALOX15HPGD
SCHEMBL10378897 0.87 MAPT (0.48) ALDH1A1MAPTHPGDNPSR1KMT2A
SCHEMBL10378898 0.87 MAPT (0.48) ALDH1A1MAPTHPGDNPSR1KMT2A
SCHEMBL10379107 0.84 KMT2A (0.39) ALDH1A1MAPTNPSR1KMT2ANPC1
SCHEMBL10377561 0.83 ALDH1A1 (0.40) ALDH1A1KDM4EMAPTHPGDNPSR1
SCHEMBL10377660 0.82 MAPT (0.46) ALDH1A1KDM4EMAPTHPGDNPSR1
SCHEMBL10377357 0.82 CYP1A2 (0.46) KMT2ANPC1POLB
SCHEMBL10377661 0.82 MAPT (0.46) ALDH1A1KDM4EMAPTHPGDNPSR1
SCHEMBL10377359 0.82 CYP1A2 (0.46) KMT2ANPC1POLB
SCHEMBL10377662 0.81 RECQL (0.43) ALDH1A1KDM4EMAPTALOX15HPGD

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-0168037-B1 1-6-NAPHTHYRIDIN-2(1H)-ONES USEFUL AS CARDIOTONICS STERLING DRUG INC. (US) 1990-02-07 — — EP disclosed
EP-0168037-A2 1-6-Naphthyridin-2(1H)-ones useful as cardiotonics STERLING DRUG INC. (US) 1986-01-15 — — EP disclosed
US-4560691-A 5-(Phenyl)-1,6-naphthyridin-2(1H)-ones, their cardiotonic use and preparation STERLING DRUG INC. (US) 1985-12-24 — — US disclosed
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