SCHEMBL18242011

SCHEMBL18242011

[O]CCc1c(F)cc(F)cc1F

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 3/20 0.39
CNR1 P21554 1/20 0.38
CES2 O00748 2/20 0.34
CES1 P23141 2/20 0.34
RIPK1 Q13546 1/20 0.34
ERN1 O75460 1/20 0.32
GPR17 Q13304 1/20 0.32
FFAR1 O14842 1/20 0.32
FFAR4 Q5NUL3 1/20 0.32
IDO1 P14902 2/20 0.31
MMP1 P03956 1/20 0.31
MMP2 P08253 1/20 0.31
MMP9 P14780 1/20 0.31
MMP12 P39900 1/20 0.31
DAO P14920 1/20 0.31
TGM2 P21980 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
SCHEMBL18243005 0.85 TAAR1 (0.37) TAAR1CNR1CES2CES1RIPK1
SCHEMBL18242970 0.83 TAAR1 (0.35) TAAR1CNR1CES2CES1RIPK1
SCHEMBL28156208 0.81 TAAR1 (0.34) TAAR1CNR1CES2CES1RIPK1
SCHEMBL96130 0.78 CES2 (0.37) TAAR1CNR1CES2CES1RIPK1
SCHEMBL15819455 0.76 TAAR1 (0.65) TAAR1CNR1
Hydrochloric Acid SCHEMBL29097400 0.74 TAAR1 (0.62) TAAR1IDO1
SCHEMBL6130263 0.74 TAAR1 (0.39) TAAR1CNR1CES2CES1RIPK1
SCHEMBL17552659 0.74 TAAR1 (0.39) TAAR1CNR1CES2CES1RIPK1
SCHEMBL6206211 0.74 TAAR1 (0.45) TAAR1CES2CES1MMP1MMP2
SCHEMBL10193863 0.74 TAAR1 (0.40) TAAR1CNR1CES2CES1RIPK1

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
US-10451967-B2 Acid- and radical-generating agent and method for generating acid and radical FUJIFILM WAKO PURE CHEMICAL CORPORATION (JP) 2019-10-22 US disclosed
CN-107141313-A Transparent oxide electrode and its production method that surface modifier, surface for transparent oxide electrode are modified 信越化学工业株式会社 2017-09-08 CN disclosed
US-20160342084-A1 ACID- AND RADICAL-GENERATING AGENT AND METHOD FOR GENERATING ACID AND RADICAL FUJIFILM WAKO PURE CHEMICAL CORPORATION (JP) 2016-11-24 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10451967-B2 Acid- and radical-generating agent and method for generating acid and radical CBR1, HAO2, CBR3 TAAR1 1102/4885CNR1 1008/4885CES2 1419/4885
US-20160342084-A1 ACID- AND RADICAL-GENERATING AGENT AND METHOD FOR GENERATING ACID AND RADICAL CBR1, HAO2, CBR3 TAAR1 1102/4885CNR1 1008/4885CES2 1419/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.