SCHEMBL29954593

SCHEMBL29954593

OB(O)[C@@H]1C[C@H]1c1cccc(Cl)c1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.51
HTR2C P28335 2/20 0.51
HTR2B P41595 2/20 0.51
SLC9A1 P19634 1/20 0.47
SLC6A3 Q01959 7/20 0.44
SLC6A2 P23975 4/20 0.41
KDM1A O60341 1/20 0.40
RCOR1 Q9UKL0 1/20 0.40
TP53 P04637 1/20 0.39
MDM2 Q00987 1/20 0.39
SLC6A4 P31645 1/20 0.38

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
SCHEMBL149599 0.79 KDM1A (0.58) HTR2AHTR2CHTR2BSLC6A3KDM1A
SCHEMBL29957178 0.79 HTR2C (0.50) HTR2AHTR2CHTR2BKDM1ARCOR1
SCHEMBL1722128 0.77 MAOB (0.48) HTR2AHTR2CHTR2BSLC6A3SLC6A2
SCHEMBL29954166 0.77 MAOB (0.48) HTR2AHTR2CHTR2BSLC6A3SLC6A2
SCHEMBL1781688 0.77 MAOB (0.48) HTR2AHTR2CHTR2BSLC6A3SLC6A2
SCHEMBL29955006 0.75 HTR2C (0.55) HTR2AHTR2CHTR2BSLC9A1KDM1A
SCHEMBL31172459 0.73 HTR2A (0.58) HTR2AHTR2CHTR2BSLC9A1SLC6A3
SCHEMBL12875538 0.73 HTR2A (0.58) HTR2AHTR2CHTR2BSLC9A1SLC6A3
SCHEMBL5521413 0.73 HTR2C (0.62) HTR2AHTR2CHTR2BSLC9A1SLC6A3
SCHEMBL7090511 0.73 HTR2C (0.62) HTR2AHTR2CHTR2BSLC9A1SLC6A3

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
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed