SCHEMBL11079168

SCHEMBL11079168

CCc1ccccc1C(CCC(N)=O)C(N)=O

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.38
CYSLTR2 Q9NS75 3/20 0.37
CYSLTR1 Q9Y271 3/20 0.37
EPHX1 P07099 1/20 0.37
FGFR1 P11362 1/20 0.34
FGFR2 P21802 1/20 0.34
FGFR4 P22455 1/20 0.34
FGFR3 P22607 1/20 0.34
MMP2 P08253 2/20 0.34
MMP9 P14780 2/20 0.34
MTNR1A P48039 2/20 0.34
TAS1R3 Q7RTX0 1/20 0.34
TAS1R1 Q7RTX1 1/20 0.34
LMNA P02545 1/20 0.33
GABRA1 P14867 1/20 0.33
GABRB2 P47870 1/20 0.33
MAPT P10636 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL5504222 0.83 EPHX1 (0.41) EPHX1FGFR1FGFR2FGFR4FGFR3
SCHEMBL11082535 0.82 ALDH1A1 (0.41) KMT2AEPHX1MMP2MMP9L3MBTL1
SCHEMBL11080114 0.82 KMT2A (0.38) KMT2AEPHX1MMP2MMP9LMNA
SCHEMBL11074931 0.80 L3MBTL1 (0.44) KMT2ALMNAMAPTNPSR1L3MBTL1
SCHEMBL7102445 0.80 KMT2A (0.39) KMT2AEPHX1MMP2MMP9LMNA
SCHEMBL11073553 0.79 LMNA (0.46) KMT2AMTNR1ALMNAMAPTNPSR1
SCHEMBL8521294 0.79 KMT2A (0.37) KMT2AEPHX1MMP2MMP9LMNA
SCHEMBL11085007 0.79 CYSLTR2 (0.37) KMT2ACYSLTR2CYSLTR1EPHX1MMP2
SCHEMBL11075944 0.79 CXCL8 (0.39) KMT2AEPHX1LMNAMAPT
SCHEMBL11078508 0.79 HTT (0.39) KMT2AEPHX1MMP2MMP9

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