SCHEMBL11082089

SCHEMBL11082089

NC(=O)CCC(C(N)=O)c1ccc(I)cc1I

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.31
GPR17 Q13304 1/20 0.31
ALOX15 P16050 1/20 0.31
BLM P54132 1/20 0.31
PMP22 Q01453 1/20 0.31
MEN1 O00255 1/20 0.31
ALB P02768 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
SCHEMBL11100628 0.81 KMT2A (0.38) KMT2AGPR17ALOX15BLMPMP22
SCHEMBL11081110 0.77 EPHX1 (0.40) KMT2AALOX15BLMPMP22ALB
SCHEMBL11079180 0.75 EPHX1 (0.39) PMP22
SCHEMBL11073329 0.73 AURKA (0.33)
SCHEMBL11081988 0.72 EPHX1 (0.35) KMT2AGPR17ALOX15BLMPMP22
SCHEMBL11074805 0.72 CES2 (0.43)
SCHEMBL11079894 0.72 KDM4E (0.34) KMT2AGPR17ALOX15MEN1
SCHEMBL11078108 0.72 LMNA (0.42)
SCHEMBL7102445 0.69 KMT2A (0.39) KMT2AALOX15BLMPMP22MEN1
SCHEMBL30699900 0.69 AURKA (0.37)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0024776-B1 4-PHENYL AND 5-PHENYL-1,4,5,6-TETRAHYDROPYRIMIDINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING SAID DERIVATIVES, AND PROCESS FOR PREPARING SAID DERIVATIVES SYNTEX (U.S.A.) INC. (US) 1984-12-27 EP disclosed
US-4322421-A 4-Phenyl-and 5-phenyl-1,4,5,6-tetrahydro-pyrimidine derivatives SYNTEX (U.S.A.) INC. (US) 1982-03-30 US disclosed
US-4261995-A DISORDERS OF CENTRAL NERVOUS SYSTEM AND CARDIOVASCULAR SYSTEM; HYPOTENSIVE SYNTEX (U.S.A.) INC. (US) 1981-04-14 US disclosed
EP-0024776-A1 4-Phenyl and 5-phenyl-1,4,5,6-tetrahydropyrimidine derivatives, pharmaceutical compositions containing said derivatives, and process for preparing said derivatives SYNTEX (U.S.A.) INC. (US) 1981-03-11 EP disclosed