SCHEMBL31448434

SCHEMBL31448434

Cc1ccc(Br)c(N)c1Oc1ccccc1C(F)F

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.33
MAPT P10636 1/20 0.33
CRHBP P24387 1/20 0.33
CRHR2 Q13324 1/20 0.33
P2RX3 P56373 1/20 0.31
P2RX2 Q9UBL9 1/20 0.31
HTR2A P28223 1/20 0.31
SLC6A4 P31645 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
SCHEMBL31448578 0.85 KDM4E (0.37) KDM4EMAPTCRHBPCRHR2
SCHEMBL31448589 0.84 HTR2A (0.33) KDM4EMAPTCRHBPCRHR2HTR2A
SCHEMBL30772390 0.82 HTR2A (0.34) HTR2ASLC6A4
SCHEMBL30772367 0.79 SMN1; SMN2 (0.36) MAPT
SCHEMBL31448613 0.78 P2RX3 (0.34) KDM4EMAPTCRHBPCRHR2P2RX3
SCHEMBL30772388 0.70 HTR2A (0.33) HTR2ASLC6A4
SCHEMBL31448428 0.70 SLC6A4 (0.34) HTR2ASLC6A4
SCHEMBL30772381 0.70 SLC6A4 (0.39) HTR2ASLC6A4
SCHEMBL30772384 0.67 SLC6A4 (0.32) HTR2ASLC6A4
SCHEMBL30772402 0.67 MEN1 (0.38) P2RX3P2RX2HTR2ASLC6A4

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
CN-119343332-A 3, 4-Dihydro-quinolin-2 (1H) -one compounds 橘生药品工业株式会社 2025-01-21 CN disclosed