SCHEMBL31346113

SCHEMBL31346113

Cc1cc(Cl)cc2c1OC(c1cccc(Br)c1)C2

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 2/20 0.35
HTR2A P28223 4/20 0.34
HTR2C P28335 4/20 0.34
HTR2B P41595 4/20 0.34
HRH3 Q9Y5N1 4/20 0.34
SIRT2 Q8IXJ6 2/20 0.34
LMNA P02545 1/20 0.34
FFAR1 O14842 1/20 0.34
CDK4 P11802 1/20 0.33
CCND1 P24385 1/20 0.33
KCNH2 Q12809 1/20 0.33
ABCB1 P08183 1/20 0.33
ABCG2 Q9UNQ0 1/20 0.33
EZH2 Q15910 1/20 0.33

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
SCHEMBL31346055 0.86 EZH2 (0.39) KDM1AHTR2AHTR2CHTR2BHRH3
SCHEMBL31346149 0.81 CYP19A1 (0.47) SIRT2LMNAFFAR1
SCHEMBL31346096 0.76 FFAR1 (0.40) KDM1AHTR2AHTR2CHTR2BHRH3
SCHEMBL31345988 0.76 FFAR1 (0.35) FFAR1
SCHEMBL31345985 0.73 TEAD1 (0.37) KDM1AHTR2AHTR2CHTR2BHRH3
SCHEMBL31345958 0.72 KDM1A (0.38) KDM1AHTR2AHTR2CHTR2BHRH3
SCHEMBL31346101 0.71 FFAR1 (0.38) KDM1AHTR2AHTR2CHTR2BHRH3
SCHEMBL18768108 0.69 AKR1B1 (0.43) EZH2
SCHEMBL31346190 0.68 FFAR1 (0.35) KDM1ASIRT2FFAR1
SCHEMBL31346103 0.68 FFAR1 (0.35) KDM1ASIRT2FFAR1

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-4712967-A2 G-PROTEIN COUPLED RECEPTOR ANTAGONIST Enveda Therapeutics, Inc. (US) 2026-03-25 EP disclosed
WO-2024239000-A2 G-PROTEIN COUPLED RECEPTOR ANTAGONIST ENVEDA THERAPEUTICS, INC. (US) 2024-11-21 WO disclosed