SCHEMBL4008185

SCHEMBL4008185

Fc1ccc(F)c(Oc2ncccc2Br)c1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PDE10A Q9Y233 1/20 0.44
▸ TRPA1 O75762 6/20 0.43
▸ HTR1A P08908 3/20 0.43
▸ SLC6A2 P23975 3/20 0.43
▸ SLC6A4 P31645 3/20 0.43
▸ SLC6A3 Q01959 1/20 0.43
▸ MAPT P10636 1/20 0.41
▸ CARM1 Q86X55 2/20 0.40
▸ P2RY1 P47900 5/20 0.39
▸ PRMT6 Q96LA8 1/20 0.39
▸ POLB P06746 1/20 0.37
▸ CYP2C9 P11712 1/20 0.37
▸ CYP2C19 P33261 1/20 0.37

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
SCHEMBL4007180 0.88 TRPA1 (0.57) PDE10ATRPA1HTR1ASLC6A2SLC6A4
SCHEMBL4012114 0.85 TRPA1 (0.49) PDE10ATRPA1HTR1ASLC6A2SLC6A4
SCHEMBL4011485 0.80 P2RY1 (0.49) PDE10ATRPA1HTR1ASLC6A2SLC6A4
SCHEMBL4008138 0.79 HTR1A (0.54) PDE10ATRPA1HTR1ASLC6A2SLC6A4
SCHEMBL4006790 0.77 HTR1A (0.56) TRPA1HTR1ASLC6A2SLC6A4SLC6A3
SCHEMBL31395515 0.77 PDE10A (0.53) PDE10ATRPA1CYP2C9CYP2C19
SCHEMBL31395497 0.76 CARM1 (0.47) PDE10ATRPA1CARM1PRMT6
SCHEMBL25216729 0.76 PDE10A (0.47) PDE10AMAPTP2RY1CYP2C19
SCHEMBL4009120 0.76 HTR1A (0.47) PDE10AHTR1ASLC6A2SLC6A4SLC6A3
SCHEMBL31395528 0.76 PDE10A (0.46) PDE10AP2RY1

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
WO-2009081259-A1 PHENOXY-PYRIDYL DERIVATIVES PFIZER INC. (US) 2009-07-02 — — WO disclosed
WO-2009081259-A1 PHENOXY-PYRIDYL DERIVATIVES PFIZER INC. (US) 2009-07-02 — — WO disclosed
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