SCHEMBL11072789

SCHEMBL11072789

CC1COc2c(ccc(Cl)c2F)N1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
AR P10275 2/20 0.43
HTR2C P28335 6/20 0.34
HTR2A P28223 2/20 0.34
HTR2B P41595 1/20 0.34
HTR1A P08908 4/20 0.32
HTR7 P34969 4/20 0.32
HTR5A P47898 4/20 0.32
HTR1D P28221 3/20 0.32
HRH1 P35367 2/20 0.30
PGR P06401 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
SCHEMBL3343457 0.83 AR (0.45) AR
SCHEMBL2330720 0.83 AR (0.45) AR
SCHEMBL8979369 0.83 AR (0.45) AR
Hydrochloric Acid SCHEMBL10575020 0.82 AR (0.44) AR
SCHEMBL10434062 0.81 AR (0.43) ARHTR2CHTR2AHTR2BPGR
SCHEMBL28588500 0.81 AR (0.40) ARHTR2CHTR1AHTR7HTR5A
SCHEMBL11854527 0.77 HTR5A (0.43) ARHTR2CHTR2AHTR1AHTR7
SCHEMBL10834821 0.74 AR (0.43) AR
SCHEMBL2599597 0.73 AR (0.42) ARPGR
SCHEMBL14567675 0.73 AR (0.44) AR

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0047005-B1 BENZOXAZINE DERIVATIVES DAIICHI SEIYAKU CO., LTD. (JP) 1984-11-14 EP disclosed
US-4382892-A Benzoxazine derivatives DAIICHI SEIYAKU CO., LTD. (JP) 1983-05-10 US disclosed
EP-0047005-A1 Benzoxazine derivatives DAIICHI SEIYAKU CO., LTD. (JP) 1982-03-10 EP disclosed