SCHEMBL8325667

SCHEMBL8325667

CCOC(=O)N(Cc1ccc(F)cc1)CC1CCCC(CI)O1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
OXTR P30559 1/20 0.40
AVPR1A P37288 1/20 0.40
MAPT P10636 2/20 0.39
PKM P14618 1/20 0.39
YAP1 P46937 1/20 0.38
TEAD4 Q15561 1/20 0.38
TEAD2 Q15562 1/20 0.38
POLB P06746 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
TP53 P04637 1/20 0.37
AGER Q15109 2/20 0.37
MTNR1A P48039 1/20 0.37
GAA P10253 2/20 0.37
ALDH1A1 P00352 1/20 0.36
USP2 O75604 1/20 0.36
LPAR1 Q92633 1/20 0.36
LPAR5 Q9H1C0 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
SCHEMBL8328218 1.00 OXTR (0.40) OXTRAVPR1AMAPTPKMYAP1
SCHEMBL8325802 1.00 OXTR (0.40) OXTRAVPR1AMAPTPKMYAP1
SCHEMBL8327746 0.90 OXTR (0.39) OXTRAVPR1AMAPTPKMYAP1
SCHEMBL8331110 0.90 OXTR (0.39) OXTRAVPR1AMAPTPKMYAP1
SCHEMBL8327750 0.90 OXTR (0.39) OXTRAVPR1AMAPTPKMYAP1
SCHEMBL8328914 0.85 SLC6A2 (0.40) OXTRAVPR1AYAP1TEAD4TEAD2
SCHEMBL8326122 0.84 HTR2A (0.38) OXTRAVPR1APKMYAP1TEAD4
SCHEMBL8331211 0.84 HTR2A (0.38) OXTRAVPR1APKMYAP1TEAD4
SCHEMBL8326125 0.84 HTR2A (0.38) OXTRAVPR1APKMYAP1TEAD4
SCHEMBL8326129 0.84 HTR2A (0.38) OXTRAVPR1APKMYAP1TEAD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0760368-B1 PYRIMIDINE DERIVATIVES NISSHIN FLOUR MILLING CO (JP) 1999-07-28 EP disclosed
EP-0760368-A1 NOVEL PYRIMIDINE DERIVATIVE NISSHIN FLOUR MILLING CO., LTD. (JP) 1997-03-05 EP disclosed