SCHEMBL2823237

SCHEMBL2823237

Cc1nc2cc(C(F)(F)F)c(F)cc2c(OC(=O)C2CC2)c1C

nearest known ligand 0.31

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDR P35968 5/20 0.31
BRAF P15056 2/20 0.31
MEN1 O00255 1/20 0.30
RAB9A P51151 1/20 0.30
KMT2A Q03164 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
SOS1 Q07889 1/20 0.30
NOTUM Q6P988 1/20 0.30
TAS1R3 Q7RTX0 1/20 0.30
TAS1R1 Q7RTX1 1/20 0.30
TAS1R2 Q8TE23 1/20 0.30
PDE2A O00408 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
SCHEMBL2820533 0.88 L3MBTL1 (0.34) MEN1RAB9AKMT2AL3MBTL1KDM4E
SCHEMBL2821034 0.84 PTGS2 (0.33) MEN1RAB9AKMT2AL3MBTL1KDM4E
SCHEMBL2819998 0.82 P2RX7 (0.32) BRAFL3MBTL1ALDH1A1PDE2A
SCHEMBL2825212 0.78 HPGD (0.34) MEN1RAB9AKMT2AL3MBTL1KDM4E
SCHEMBL2823483 0.75 KDM4E (0.32) MEN1RAB9AKMT2AL3MBTL1KDM4E
SCHEMBL2822997 0.74 L3MBTL1 (0.33) MEN1RAB9AKMT2AL3MBTL1ALDH1A1
SCHEMBL2819937 0.74 USP2 (0.38) MEN1RAB9AKMT2AL3MBTL1KDM4E
SCHEMBL2820687 0.72 AR (0.33)
SCHEMBL2823045 0.71 KMT2A (0.33) MEN1RAB9AKMT2AL3MBTL1KDM4E
SCHEMBL2819903 0.71 USP2 (0.36) MEN1RAB9AKMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1386914-B1 HALOGENATED QUINOLINE DERIVATIVES AND ECTOPARASITE CONTROLLERS MEIJI SEIKA KAISHA (JP) 2010-10-27 EP disclosed
US-7022855-B2 Halogen-substituted quinoline derivatives and ectoparasite control agent MEIJI SEIKA KAISHA, LTD. (JP) 2006-04-04 US disclosed
EP-1559321-A1 MIXED COMPOSITIONS FOR CONTROLLING PARASITIC INSECTS MEIJI SEIKA KAISHA LTD. (JP) 2005-08-03 EP disclosed
US-20040087618-A1 Halogen-substituted quinoline derivatives and ectoparasite control agent MEIJI SEIKA KAISHA, LTD. (JP) 2004-05-06 US disclosed
US-20040077602-A1 Mixture composition for controlling ectoparasites MEIJI SEIKA KAISHA, LTD. (JP) 2004-04-22 US disclosed
EP-1386914-A1 HALOGENATED QUINOLINE DERIVATIVES AND ECTOPARASITE CONTROLLERS MEIJI SEIKA KAISHA LTD. (JP) 2004-02-04 EP 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-20040087618-A1 Halogen-substituted quinoline derivatives and ectoparasite control agent ATL3, RABL3, RAB5C KDR 3790/4885BRAF 163/4885MEN1 3131/4885
US-20040077602-A1 Mixture composition for controlling ectoparasites SF3A3, PEX3, HCN3 KDR 3073/4885BRAF 51/4885MEN1 2772/4885

“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.