SCHEMBL10737830

SCHEMBL10737830

COc1ccc(SCn2cc(Cl)cnc2=O)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ PDE2A O00408 1/20 0.40
▸ MTNR1A P48039 1/20 0.38
▸ MTNR1B P49286 1/20 0.38
▸ TP53 P04637 3/20 0.38
▸ POLB P06746 2/20 0.38
▸ LMNA P02545 1/20 0.38
▸ NPC1 O15118 3/20 0.38
▸ DAO P14920 2/20 0.38
▸ ALDH1A1 P00352 4/20 0.37
▸ MAPT P10636 3/20 0.37
▸ HPGD P15428 2/20 0.37
▸ HTT P42858 2/20 0.37
▸ RAB9A P51151 2/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ GAA P10253 1/20 0.37
▸ L3MBTL1 Q9Y468 3/20 0.37
▸ HRH3 Q9Y5N1 1/20 0.36

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
SCHEMBL10738423 0.86 ALDH1A1 (0.41) KMT2AKDM4ENPC1ALDH1A1MAPT
SCHEMBL10745802 0.81 DAO (0.35) KMT2AKDM4ELMNANPC1DAO
SCHEMBL10737230 0.78 IDO1 (0.44) KMT2AKDM4ETP53POLBLMNA
SCHEMBL10734700 0.78 NPC1 (0.51) KMT2AKDM4ELMNANPC1ALDH1A1
SCHEMBL10813483 0.75 EGLN1 (0.43) PDE2ATP53LMNANPC1ALDH1A1
SCHEMBL10742281 0.75 GRIN2B (0.37) KMT2ATP53POLBLMNANPC1
SCHEMBL10737268 0.70 RAB9A (0.42) KDM4EPOLBNPC1ALDH1A1MAPT
SCHEMBL10740627 0.70 ALDH1A1 (0.39) KDM4EPOLBLMNANPC1ALDH1A1
SCHEMBL10735574 0.69 POLB (0.52) KMT2ATP53POLBNPC1ALDH1A1
SCHEMBL10732422 0.69 CDYL (0.56) KDM4ETP53POLBNPC1MAPT

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-0056319-B1 SUBSTITUTED PYRIMIDIN-2-ONES AND THE SALTS THEREOF NYEGAARD & CO. A/S (NO) 1986-04-16 — — EP claimed
EP-0056319-A2 Substituted pyrimidin-2-ones and the salts thereof NYEGAARD & CO. A/S (NO) 1982-07-21 — — EP claimed
US-4705791-A ANTICARCINOGENIC AGENTS, IMMUNOLOGY, SKIN DISORDERS NYEGAARD & CO. A/S (NO) 1987-11-10 — — US disclosed
US-4596870-A Substituted pyrimidin-2-ones and the salts thereof NYEGAARD & CO. A.S. (NO) 1986-06-24 — — US disclosed
EP-0056319-B1 SUBSTITUTED PYRIMIDIN-2-ONES AND THE SALTS THEREOF NYEGAARD & CO. A/S (NO) 1986-04-16 — — EP disclosed
EP-0056319-A2 Substituted pyrimidin-2-ones and the salts thereof NYEGAARD & CO. A/S (NO) 1982-07-21 — — EP disclosed
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