SCHEMBL7601736

SCHEMBL7601736

Fc1ccc(C(F)(F)F)c(C(F)(F)F)c1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.50
KIF11 P52732 2/20 0.39
TRPA1 O75762 2/20 0.39
NOTUM Q6P988 1/20 0.38
CYP11B2 P19099 1/20 0.38
RXRA P19793 1/20 0.37
RXRB P28702 1/20 0.37
RXRG P48443 1/20 0.37
AR P10275 4/20 0.37
HCAR1 Q9BXC0 1/20 0.37
GLA P06280 1/20 0.36
POLB P06746 1/20 0.36
GAA P10253 1/20 0.36
TSHR P16473 1/20 0.36
CES2 O00748 1/20 0.35

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
SCHEMBL8225495 0.85 IDO1 (0.44) IDO1KIF11TRPA1CYP11B2AR
SCHEMBL8221055 0.85 IDO1 (0.44) IDO1KIF11TRPA1CYP11B2AR
SCHEMBL25012780 0.84 IDO1 (0.43) IDO1KIF11TRPA1CYP11B2AR
SCHEMBL31409922 0.82 IDO1 (0.46) IDO1KIF11TRPA1CYP11B2GLA
SCHEMBL29775945 0.81 IDO1 (0.48) IDO1KIF11ARCES2
SCHEMBL21131387 0.81 TRPA1 (0.49) IDO1KIF11TRPA1CYP11B2AR
SCHEMBL29490960 0.81 KIF11 (0.52) IDO1KIF11CYP11B2AR
SCHEMBL7265211 0.81 IDO1 (0.48) IDO1KIF11ARCES2
SCHEMBL4084187 0.81 KIF11 (0.52) IDO1KIF11CYP11B2AR
SCHEMBL30568360 0.81 TRPA1 (0.49) IDO1KIF11TRPA1CYP11B2AR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2951169-B1 FLAP MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2019-08-28 EP disclosed
US-9926333-B2 Flap modulators JANSSEN PHARMACEUTICA NV (BE) 2018-03-27 US disclosed
US-20170327514-A1 FLAP MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2017-11-16 US disclosed
US-9732093-B2 FLAP modulators JANSSEN PHARMACEUTICA NV (BE) 2017-08-15 US disclosed
US-20150368270-A1 FLAP MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2015-12-24 US disclosed
EP-2951169-A1 FLAP MODULATORS Janssen Pharmaceutica, N.V. (BE) 2015-12-09 EP disclosed
US-20150252008-A1 FLAP MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2015-09-10 US disclosed
US-9073876-B2 Flap modulators JANSSEN PHARMACEUTICA NV (BE) 2015-07-07 US disclosed
US-20140221310-A1 FLAP MODULATORS JANSSEN PHARMACEUTICA NV (US) 2014-08-07 US disclosed
WO-2014121040-A1 FLAP MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2014-08-07 WO disclosed
US-20020042541-A1 Process for producing bis( trifluoromethyl)benzaldehyde CENTRAL GLASS COMPANY, LIMITED (JP) 2002-04-11 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 (5 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-20170327514-A1 FLAP MODULATORS FEN1, PGF, TBXA2R IDO1 568/4885KIF11 2575/4885TRPA1 3157/4885
US-20140221310-A1 FLAP MODULATORS FEN1, PGF, PTGIS IDO1 762/4885KIF11 2514/4885TRPA1 3339/4885
US-20150368270-A1 FLAP MODULATORS FEN1, PGF, TBXA2R IDO1 568/4885KIF11 2575/4885TRPA1 3157/4885
US-20020042541-A1 Process for producing bis( trifluoromethyl)benzaldehyde BRPF1, PFAS, FLI1 IDO1 521/4885KIF11 4519/4885TRPA1 1222/4885
US-20150252008-A1 FLAP MODULATORS FEN1, PGF, PTGIS IDO1 762/4885KIF11 2514/4885TRPA1 3339/4885

“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.