SCHEMBL18389397

SCHEMBL18389397

CC(C)(C)NC(=O)c1cc(-c2ccc(C(F)(F)F)cc2)nc(-n2ccnc2C(C)(C)C)c1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
P2RY14 Q15391 3/20 0.42
MCHR1 Q99705 3/20 0.42
ADORA3 P0DMS8 1/20 0.41
RIPK1 Q13546 1/20 0.39
ALOX5AP P20292 2/20 0.38
FEN1 P39748 2/20 0.38
HDAC1 Q13547 2/20 0.38
KDM1A O60341 1/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HPGD P15428 1/20 0.38
TRPV1 Q8NER1 1/20 0.38
KDM2B Q8NHM5 1/20 0.36
KDM4C Q9H3R0 1/20 0.36
POLB P06746 1/20 0.36
TDO2 P48775 1/20 0.36

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
SCHEMBL18389428 0.93 P2RY14 (0.42) P2RY14MCHR1ADORA3RIPK1ALOX5AP
SCHEMBL18389327 0.90 MAPT (0.39) ADORA3RIPK1ALOX5APFEN1ALDH1A1
SCHEMBL20127047 0.89 KDM4E (0.44) P2RY14MCHR1ADORA3RIPK1ALOX5AP
SCHEMBL20127046 0.89 RIPK1 (0.38) ADORA3RIPK1HDAC1KDM1AALDH1A1
SCHEMBL18389322 0.88 CNR1 (0.43) ADORA3RIPK1
SCHEMBL18389516 0.86 P2RY14 (0.41) P2RY14MCHR1ADORA3RIPK1ALOX5AP
SCHEMBL20127045 0.86 KMO (0.37) RIPK1ALOX5APFEN1ALDH1A1KDM4C
SCHEMBL18389521 0.86 NPC1 (0.45) ADORA3HDAC1KDM1AKDM4EALDH1A1
SCHEMBL21004125 0.86 RIPK1 (0.36) P2RY14RIPK1KDM4EALDH1A1HPGD
SCHEMBL18389351 0.85 EGLN1 (0.44) RIPK1KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107709311-B 2-phenyl-6-imidazolyl-pyridine-4-carboxamide derivatives and their use as EAAT3 inhibitors 豪夫迈·罗氏有限公司 2020-09-25 CN claimed
EP-3322699-B1 2-PHENYL-6-IMIDAZOLYL-PYRIDINE-4-CARBOXAMIDE DERIVATIVES AND THEIR USE AS EAAT3 INHIBITORS HOFFMANN LA ROCHE (CH) 2019-05-15 EP claimed
CN-107709311-B 2-phenyl-6-imidazolyl-pyridine-4-carboxamide derivatives and their use as EAAT3 inhibitors 豪夫迈·罗氏有限公司 2020-09-25 CN disclosed
EP-3322699-B1 2-PHENYL-6-IMIDAZOLYL-PYRIDINE-4-CARBOXAMIDE DERIVATIVES AND THEIR USE AS EAAT3 INHIBITORS HOFFMANN LA ROCHE (CH) 2019-05-15 EP disclosed
US-20180125823-A1 IMIDAZOLE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2018-05-10 US disclosed
US-20180125823-A1 IMIDAZOLE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2018-05-10 US disclosed
WO-2017009274-A1 2-PHENYL-6-IMIDAZOLYL-PYRIDINE-4-CARBOXAMIDE DERIVATIVES AND THEIR USE AS EAAT3 INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2017-01-19 WO 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-20180125823-A1 IMIDAZOLE DERIVATIVES OXTR, DRD3, MC3R P2RY14 3542/4885MCHR1 36/4885ADORA3 316/4885

“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.