SCHEMBL2822997

SCHEMBL2822997

Cc1c(C(C)C)nc2cc(F)c(F)cc2c1OC(=O)C1CC1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.33
CYP11B1 P15538 4/20 0.32
CYP11B2 P19099 4/20 0.32
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
RAB9A P51151 2/20 0.32
MAPT P10636 1/20 0.31
NPC1 O15118 1/20 0.31
ALDH1A1 P00352 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 0.85 L3MBTL1 (0.34) L3MBTL1CYP11B1CYP11B2MEN1KMT2A
SCHEMBL2823274 0.83 DHODH (0.31) ALDH1A1
SCHEMBL2819937 0.81 USP2 (0.38) L3MBTL1CYP11B1CYP11B2MEN1KMT2A
SCHEMBL2823000 0.77 USP2 (0.37) L3MBTL1CYP11B1CYP11B2MEN1KMT2A
SCHEMBL2821034 0.76 PTGS2 (0.33) L3MBTL1MEN1KMT2ARAB9ANPC1
SCHEMBL2823237 0.74 KDR (0.31) L3MBTL1MEN1KMT2ARAB9AALDH1A1
SCHEMBL2819903 0.73 USP2 (0.36) MEN1KMT2ARAB9AMAPTNPC1
SCHEMBL2823211 0.71 LMNA (0.38) ALDH1A1
SCHEMBL2820524 0.70 GCGR (0.33) CYP11B1CYP11B2
SCHEMBL2825212 0.70 HPGD (0.34) L3MBTL1MEN1KMT2ARAB9ANPC1

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 L3MBTL1 130/4885CYP11B1 2551/4885CYP11B2 2349/4885
US-20040077602-A1 Mixture composition for controlling ectoparasites SF3A3, PEX3, HCN3 L3MBTL1 156/4885CYP11B1 537/4885CYP11B2 446/4885

“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.