SCHEMBL10808373

SCHEMBL10808373

CN(C)C=Cc1[nH]c(=O)ccc1C(=O)c1ccoc1

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 1/20 0.33
▸ MAPT P10636 3/20 0.33
▸ KDM4E B2RXH2 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ CYP2D6 P10635 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ TRPA1 O75762 1/20 0.31
▸ RECQL P46063 1/20 0.30
▸ CYP3A4 P08684 1/20 0.30

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
SCHEMBL10808370 1.00 DRD2 (0.33) DRD2MAPTKDM4EMEN1ALDH1A1
SCHEMBL10377663 0.82 RECQL (0.43) MAPTKDM4EMEN1ALDH1A1CYP1A2
SCHEMBL10377662 0.82 RECQL (0.43) MAPTKDM4EMEN1ALDH1A1CYP1A2
SCHEMBL10377561 0.81 ALDH1A1 (0.40) MAPTKDM4EMEN1ALDH1A1HPGD
SCHEMBL10377563 0.81 ALDH1A1 (0.40) MAPTKDM4EMEN1ALDH1A1HPGD
SCHEMBL10377661 0.80 MAPT (0.46) MAPTKDM4EMEN1ALDH1A1CYP1A2
SCHEMBL10377359 0.80 CYP1A2 (0.46) MEN1CYP1A2CYP2C19KMT2A
SCHEMBL10377660 0.80 MAPT (0.46) MAPTKDM4EMEN1ALDH1A1CYP1A2
SCHEMBL10378505 0.80 LMNA (0.46) MAPTMEN1ALDH1A1HPGDKMT2A
SCHEMBL10377357 0.80 CYP1A2 (0.46) MEN1CYP1A2CYP2C19KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0096890-B1 OXAZOLEACETIC ACID DERIVATIVES, PROCESS FOR THEIR PRODUCTION AND COMPOSITIONS CONTAINING SAID DERIVATIVES Takeda Chemical Industries, Ltd. (JP) 1987-11-25 — — EP disclosed
EP-0101023-B1 PROCESS FOR PREPARING 2-CARBAMOYLOXYALKYL-1,4-DIHYDROPYRIDINE DERIVATIVES AND INTERMEDIATES USEFUL FOR THE PROCESS BANYU PHARMACEUTICAL CO., LTD. (JP) 1987-07-29 — — EP disclosed
US-4650806-A Cardiotonic 5-(heterylcarbonyl)-pyridones STERLING DRUG INC. (US) 1987-03-17 — — US disclosed
EP-0191298-A2 1,6 -Naphthyridin-2(1H) - ones useful as cardiotonics and preparation thereof STERLING DRUG INC. (US) 1986-08-20 — — EP disclosed
US-4602027-A HYPOGLYCEMIC AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1986-07-22 — — US disclosed
US-4567186-A 5-Heteryl-1,6-naphthyridin-2(1H)-ones, cardiotonic use thereof and intermediates therefor STERLING DRUG INC. (US) 1986-01-28 — — US disclosed
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