SCHEMBL8735310

SCHEMBL8735310

OCC1(O)C=C(Cl)C(c2ccccc2)C(C(F)(F)F)=C1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.33
HTR2A P28223 2/20 0.31
HTR2C P28335 2/20 0.31
HTR2B P41595 2/20 0.31
PDK2 Q15119 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
SCHEMBL8736550 0.72 HTR2A (0.32) KDM1AHTR2AHTR2CHTR2B
SCHEMBL6058559 0.68 KDM1A (0.41) KDM1AHTR2AHTR2CHTR2B
SCHEMBL8736494 0.67 KDM1A (0.33) KDM1A
SCHEMBL8736634 0.63 KDM1A (0.36) KDM1A
SCHEMBL5608796 0.60 KDM1A (0.33) KDM1A
SCHEMBL8733740 0.60 LMNA (0.34) KDM1A
SCHEMBL8737332 0.59 KDM1A (0.33) KDM1A
SCHEMBL7398947 0.57 KDM1A (0.39) KDM1AHTR2AHTR2CHTR2B
SCHEMBL4658876 0.56 HTR2A (0.35) KDM1AHTR2AHTR2CHTR2B
SCHEMBL9489237 0.55 KDM1A (0.44) KDM1AHTR2AHTR2CHTR2B

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-0877607-A1 BIPHENYL COMPOUNDS AND USE THEREOF AS OESTROGENIC AGENTS HOECHST MARION ROUSSEL (FR) 1998-11-18 EP claimed
WO-1997027846-A1 BIPHENYL COMPOUNDS AND USE THEREOF AS OESTROGENIC AGENTS HOECHST MARION ROUSSEL (FR) 1997-08-07 WO claimed