SCHEMBL23940689

SCHEMBL23940689

Bc1ccc(F)cc1CCC1OC1CO

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 11/20 0.34
SLC6A4 P31645 11/20 0.34
SLC6A3 Q01959 11/20 0.34
MDM4 O15151 1/20 0.30
TP53 P04637 1/20 0.30
MDM2 Q00987 1/20 0.30
TYR P14679 1/20 0.30
SLC5A1 P13866 1/20 0.30
SLC5A2 P31639 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 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
SCHEMBL20006794 0.82 SLC6A4 (0.42) SLC6A2SLC6A4SLC6A3SLC5A1SLC5A2
SCHEMBL23940705 0.78 SLC6A2 (0.34) SLC6A2SLC6A4SLC6A3SLC5A2CYP3A4
SCHEMBL24316905 0.75 TAAR1 (0.47) SLC6A3SLC5A2
SCHEMBL20007142 0.74 SLC6A2 (0.42) SLC6A2SLC6A4SLC6A3CYP3A4CYP2C9
SCHEMBL18255228 0.73 SLC6A2 (0.41) SLC6A2SLC6A4SLC6A3
SCHEMBL18255230 0.73 SLC6A2 (0.41) SLC6A2SLC6A4SLC6A3
SCHEMBL18255229 0.73 SLC6A2 (0.41) SLC6A2SLC6A4SLC6A3
SCHEMBL19988037 0.72 HTR1A (0.43) SLC6A2SLC6A4SLC6A3SLC5A1SLC5A2
SCHEMBL19988040 0.72 HTR1A (0.43) SLC6A2SLC6A4SLC6A3SLC5A1SLC5A2
SCHEMBL19988048 0.72 HTR1A (0.43) SLC6A2SLC6A4SLC6A3SLC5A1SLC5A2

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-3299364-B1 NEBIVOLOL SYNTHESIS METHOD AND INTERMEDIATE COMPOUND THEREOF ZHEJIANG AUSUN PHARMACEUTICAL CO LTD (CN) 2021-10-20 EP disclosed