SCHEMBL24316909

SCHEMBL24316909

OCC/C=C/CCCc1cc(F)ccc1OCc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 2/20 0.44
PTGER4 P35408 2/20 0.44
PTGER3 P43115 2/20 0.44
PTGER2 P43116 2/20 0.44
HTR1A P08908 1/20 0.43
DRD2 P14416 1/20 0.43
MGLL Q99685 1/20 0.43
BCHE P06276 1/20 0.42
LMNA P02545 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
MTNR1A P48039 2/20 0.42
MTNR1B P49286 1/20 0.42
TRPV6 Q9H1D0 1/20 0.41
USP28 Q96RU2 1/20 0.41
USP25 Q9UHP3 1/20 0.41
FFAR1 O14842 1/20 0.41
FFAR4 Q5NUL3 1/20 0.41
ABCB1 P08183 1/20 0.41
ABCG2 Q9UNQ0 1/20 0.41
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL19988047 0.85 HTR1A (0.46) PTGER1PTGER4PTGER3PTGER2HTR1A
SCHEMBL19988043 0.85 HTR1A (0.46) PTGER1PTGER4PTGER3PTGER2HTR1A
SCHEMBL20179453 0.85 MGLL (0.52) PTGER1PTGER4PTGER3PTGER2HTR1A
SCHEMBL18894534 0.84 HTR1A (0.53) PTGER1PTGER4PTGER3PTGER2HTR1A
SCHEMBL6216285 0.79 ELANE (0.53) HTR1ADRD2LMNAL3MBTL1USP28
SCHEMBL24263356 0.78 ABCB1 (0.46) HTR1ADRD2BCHELMNAL3MBTL1
SCHEMBL20006868 0.78 PTGER1 (0.44) PTGER1PTGER4PTGER3PTGER2HTR1A
SCHEMBL24316795 0.77 PTGER1 (0.46) PTGER1PTGER4PTGER3PTGER2HTR1A
SCHEMBL16797594 0.76 HTR1A (0.53) HTR1ADRD2BCHELMNAL3MBTL1
SCHEMBL28020148 0.76 HTR1A (0.53) PTGER1HTR1ADRD2MGLLLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3974419-A2 NEBIVOLOL SYNTHESIS METHOD AND INTERMEDIATE COMPOUND THEREOF Zhejiang Ausun Pharmaceutical Co., Ltd. (CN) 2022-03-30 EP disclosed