SCHEMBL24901027

SCHEMBL24901027

C=Cc1cc2ccn(CCO)c2cc1F

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTR2A P28223 6/20 0.46
▸ HTR2C P28335 6/20 0.46
▸ P2RX7 Q99572 1/20 0.35
▸ ACACB O00763 1/20 0.34
▸ HTR7 P34969 2/20 0.34
▸ HDAC1 Q13547 1/20 0.34
▸ HDAC6 Q9UBN7 1/20 0.34
▸ KDM1A O60341 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ HTR2B P41595 1/20 0.33
▸ PLG P00747 1/20 0.33
▸ PLAU P00749 1/20 0.33
▸ FGFR1 P11362 1/20 0.32
▸ FGFR4 P22455 1/20 0.32
▸ KMO O15229 1/20 0.32
▸ CDK4 P11802 1/20 0.32
▸ CCND1 P24385 1/20 0.32
▸ MET P08581 1/20 0.31

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
SCHEMBL25310206 0.82 HTR2A (0.63) HTR2AHTR2CP2RX7ACACBHTR7
SCHEMBL30515265 0.82 HTR2A (0.63) HTR2AHTR2CP2RX7ACACBHTR7
SCHEMBL23519846 0.80 KMT2A (0.48) HTR2AHTR2CFGFR1FGFR4KMO
SCHEMBL18911998 0.79 HTR2A (0.40) HTR2AHTR2CKDM1ACYP1A2CYP3A4
SCHEMBL18912161 0.79 HTR2A (0.40) HTR2AHTR2CKDM1ACYP1A2CYP3A4
SCHEMBL18911877 0.77 HTR2C (0.53) HTR2AHTR2CP2RX7ACACBHTR7
SCHEMBL3481149 0.77 HTR2A (0.49) HTR2AHTR2CP2RX7ACACBHTR7
SCHEMBL18912153 0.76 CYP2A6 (0.41) HTR2AHTR2C
SCHEMBL21936808 0.76 KRAS (0.41) HTR2AHTR2CKDM1A
SCHEMBL18912005 0.76 GRIN2B (0.46) HTR2AHTR2C

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-3381896-B1 BIPHENYL COMPOUND OR SALT THEREOF TAIHO PHARMACEUTICAL CO LTD (JP) 2023-01-18 — — EP disclosed
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