SCHEMBL11229522

SCHEMBL11229522

N#CCc1ccc(Oc2ccc(C(F)(F)F)cc2Cl)cc1

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 4/20 0.60
MRGPRX4 Q96LA9 6/20 0.48
HTR2A P28223 4/20 0.46
SLC6A4 P31645 4/20 0.46
KCNH2 Q12809 4/20 0.46
MEN1 O00255 1/20 0.45
TTR P02766 1/20 0.45
PPOX P50336 1/20 0.45
KMT2A Q03164 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.42
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.42
ATM Q13315 1/20 0.42
RAB9A P51151 1/20 0.42

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
SCHEMBL10482083 0.84 HTR2A (0.53) FFAR1MRGPRX4HTR2ASLC6A4KCNH2
SCHEMBL11095176 0.84 FFAR1 (0.65) FFAR1MRGPRX4HTR2ASLC6A4KCNH2
SCHEMBL11222733 0.83 FFAR1 (0.66) FFAR1MRGPRX4HTR2ASLC6A4KCNH2
SCHEMBL921043 0.82 FFAR1 (0.64) FFAR1MRGPRX4HTR2ASLC6A4KCNH2
SCHEMBL12967470 0.82 FFAR1 (0.64) FFAR1MRGPRX4HTR2ASLC6A4KCNH2
SCHEMBL921021 0.82 FFAR1 (0.54) FFAR1MRGPRX4HTR2ASLC6A4KCNH2
SCHEMBL17042865 0.80 FFAR1 (0.69) FFAR1MRGPRX4HTR2ASLC6A4KCNH2
SCHEMBL10969104 0.79 FFAR1 (0.60) FFAR1HTR2ASLC6A4KCNH2MEN1
SCHEMBL17085326 0.79 HTR2A (0.43) FFAR1HTR2ASLC6A4KCNH2L3MBTL1
Hydrochloric Acid SCHEMBL17042503 0.78 FFAR1 (0.67) FFAR1MRGPRX4MEN1TTRPPOX

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-2913325-B1 SUBSTITUTED PYRIMIDINE COMPOUND AND USES THEREOF SHENYANG SINOCHEM AGROCHEMICALS R & D CO LTD (CN) 2021-04-21 EP disclosed
EP-2913325-B1 SUBSTITUTED PYRIMIDINE COMPOUND AND USES THEREOF SHENYANG SINOCHEM AGROCHEMICALS R & D CO LTD (CN) 2021-04-21 EP disclosed
EP-3760617-A1 SUBSTITUTED PYRIMIDINE COMPOUND AND USES THEREOF Shenyang Sinochem Agrochemicals R&D Co., Ltd. (CN) 2021-01-06 EP disclosed
EP-3760617-A1 SUBSTITUTED PYRIMIDINE COMPOUND AND USES THEREOF Shenyang Sinochem Agrochemicals R&D Co., Ltd. (CN) 2021-01-06 EP disclosed
US-9770026-B2 Substituted pyrimidine compound and uses thereof SHENYANG SINOCHEM AGROCHEMICALS R&D CO., LTD. (CN) 2017-09-26 US disclosed
US-9770026-B2 Substituted pyrimidine compound and uses thereof SHENYANG SINOCHEM AGROCHEMICALS R&D CO., LTD. (CN) 2017-09-26 US disclosed
US-20150257385-A1 Substituted Pyrimidine Compound and Uses Thereof SHENYANG SINOCHEM AGROCHEMICALS R&D CO., LTD. (CN) 2015-09-17 US disclosed
US-20150257385-A1 Substituted Pyrimidine Compound and Uses Thereof SHENYANG SINOCHEM AGROCHEMICALS R&D CO., LTD. (CN) 2015-09-17 US disclosed
EP-2913325-A1 SUBSTITUTED PYRIMIDINE COMPOUND AND USES THEREOF Sinochem Corporation (CN) 2015-09-02 EP disclosed
WO-2014063642-A1 SUBSTITUTED PYRIMIDINE COMPOUND AND USES THEREOF 中国中化股份有限公司 (CN) 2014-05-01 WO disclosed
US-4353736-A CROPS OF BARLEY, WHEAT, CORN, RICE OR COATS CIBA-GEIGY CORPORATION (US) 1982-10-12 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 (1 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-20150257385-A1 Substituted Pyrimidine Compound and Uses Thereof TYR, GART, LRRK2 FFAR1 3670/4885MRGPRX4 2561/4885HTR2A 1909/4885

“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.