SCHEMBL1148826

SCHEMBL1148826

Cc1cc(N)ccc1Oc1ccc(OC(F)(F)F)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 6/20 0.44
SLC6A2 P23975 5/20 0.44
SLC6A3 Q01959 3/20 0.44
L3MBTL1 Q9Y468 2/20 0.41
RAB9A P51151 1/20 0.41
ALDH1A1 P00352 3/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MCHR1 Q99705 1/20 0.40
TEAD4 Q15561 1/20 0.39
GRIN2B Q13224 1/20 0.39
MAPT P10636 3/20 0.39
KDM4E B2RXH2 1/20 0.39
GAA P10253 1/20 0.39
MAPK1 P28482 1/20 0.39
FFAR4 Q5NUL3 1/20 0.38
LMNA P02545 1/20 0.38
ATM Q13315 1/20 0.38
POLB P06746 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
FFAR1 O14842 1/20 0.38

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
SCHEMBL1242525 0.87 SLC6A4 (0.42) SLC6A4SLC6A2SLC6A3L3MBTL1RAB9A
SCHEMBL2749090 0.86 MAPT (0.45) L3MBTL1ALDH1A1SMN1; SMN2MAPTGAA
SCHEMBL2992329 0.86 ALDH1A1 (0.52) SLC6A4RAB9AALDH1A1SMN1; SMN2TEAD4
SCHEMBL3003478 0.84 ALDH1A1 (0.55) RAB9AALDH1A1SMN1; SMN2TEAD4MAPT
SCHEMBL29688467 0.84 ALDH1A1 (0.55) RAB9AALDH1A1SMN1; SMN2TEAD4MAPT
SCHEMBL1155719 0.84 ALDH1A1 (0.55) RAB9AALDH1A1SMN1; SMN2TEAD4MAPT
SCHEMBL31457276 0.84 ALDH1A1 (0.55) RAB9AALDH1A1SMN1; SMN2TEAD4MAPT
SCHEMBL10627888 0.84 FFAR4 (0.42) SLC6A4FFAR4FFAR1PPARD
SCHEMBL22199038 0.83 GPR3 (0.47) SLC6A4SLC6A2SLC6A3MCHR1FFAR4
SCHEMBL9204260 0.83 ALDH1A1 (0.46) L3MBTL1ALDH1A1SMN1; SMN2MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210040041-A1 QUINOLINE DERIVATIVES AND PREPARATION METHODS AND USES THEREOF Dongguan HEC Pesticides R&D Co., Ltd. (CN) 2021-02-11 US disclosed
EP-1780202-B1 QUINOLINE DERIVATIVE AND INSECTICIDE CONTAINING SAME AS ACTIVE CONSTITUENT MEIJI SEIKA PHARMA CO LTD (JP) 2013-02-27 EP disclosed
US-7880006-B2 4-Acetoxy-5-chloro-6-(4-chlorophenoxy)-2,3-dimethyl-quinoline, used as agricultural and horticultural insecticides MEIJI SEIKA KAISHA, LTD. (JP) 2011-02-01 US disclosed
US-20070203181-A1 Quinoline Derivatives And Insecticide Comprising Thereof As Active Ingredient MEIJI SEIKA KAISHA, LTD. (JP) 2007-08-30 US disclosed
EP-1780202-A1 QUINOLINE DERIVATIVE AND INSECTICIDE CONTAINING SAME AS ACTIVE CONSTITUENT MEIJI SEIKA KAISHA LTD. (JP) 2007-05-02 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-20210040041-A1 QUINOLINE DERIVATIVES AND PREPARATION METHODS AND USES THEREOF NQO2, RDX, RIN1 SLC6A4 2488/4885SLC6A2 1227/4885SLC6A3 1510/4885
US-20070203181-A1 Quinoline Derivatives And Insecticide Comprising Thereof As Active Ingredient DDT, ACHE, NQO1 SLC6A4 1492/4885SLC6A2 695/4885SLC6A3 905/4885

“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.