SCHEMBL10620692

SCHEMBL10620692

Cc1cc(C(=O)c2ccccc2C(F)(F)F)cc([N+](=O)[O-])c1O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 6/20 0.55
GPR35 Q9HC97 3/20 0.55
ALDH1A1 P00352 3/20 0.55
TSHR P16473 3/20 0.55
KDM4E B2RXH2 2/20 0.55
MEN1 O00255 1/20 0.55
GMNN O75496 1/20 0.55
LMNA P02545 1/20 0.55
TP53 P04637 1/20 0.55
CYP3A4 P08684 1/20 0.55
MAPT P10636 1/20 0.55
THRB P10828 1/20 0.55
CYP2C9 P11712 1/20 0.55
HPGD P15428 1/20 0.55
NFKB1 P19838 1/20 0.55
MAPK1 P28482 1/20 0.55
RECQL P46063 1/20 0.55
RAB9A P51151 1/20 0.55
BLM P54132 1/20 0.55
GFER P55789 1/20 0.55

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
SCHEMBL10621489 0.91 TTR (0.61) TTRGPR35ALDH1A1TSHRKDM4E
SCHEMBL10618285 0.89 LMNA (0.45) TTRGPR35ALDH1A1TSHRKDM4E
SCHEMBL7370239 0.88 TTR (0.72) TTRGPR35ALDH1A1TSHRKDM4E
SCHEMBL10619415 0.86 TTR (0.53) TTRGPR35ALDH1A1TSHRKDM4E
SCHEMBL10618714 0.85 TTR (0.55) TTRGPR35ALDH1A1TSHRKDM4E
SCHEMBL10620784 0.85 TTR (0.52) TTRGPR35ALDH1A1TSHRKDM4E
SCHEMBL7367724 0.85 TTR (0.57) TTRGPR35ALDH1A1TSHRKDM4E
SCHEMBL16450343 0.84 TTR (0.78) TTRGPR35ALDH1A1TSHRKDM4E
SCHEMBL10619447 0.83 TTR (0.50) TTRGPR35ALDH1A1TSHRKDM4E
SCHEMBL10621461 0.81 LMNA (0.47) TTRGPR35ALDH1A1TSHRKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-60172946-A None JP disclosed
EP-0118661-B1 FLUORINE-CONTAINING BENZOPHENONE DERIVATIVES Daikin Kogyo Co., Ltd. (JP) 1988-04-13 EP disclosed
JP-S60172946-A FLUORINE-CONTAINING BENZOPHENONE DERIVATIVE AND ITS USE DAIKIN IND LTD 1985-09-06 JP disclosed
EP-0118661-A2 Fluorine-containing benzophenone derivatives Daikin Kogyo Co., Ltd. (JP) 1984-09-19 EP disclosed