SCHEMBL2116301

SCHEMBL2116301

Cn1cc(Cl)cc(Cl)c1=O

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.44
RAB9A P51151 1/20 0.44
KMT2A Q03164 1/20 0.44
GAA P10253 3/20 0.40
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 2/20 0.40
BRD4 O60885 14/20 0.39
BRD2 P25440 11/20 0.39
BRD3 Q15059 11/20 0.39
CREBBP Q92793 6/20 0.39
F2RL3 Q96RI0 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
ACLY P53396 1/20 0.35

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
SCHEMBL15975168 0.84 BRD4 (0.40) MEN1RAB9AKMT2AGAAKDM4E
SCHEMBL15148291 0.79 BRD4 (0.50) MEN1RAB9AKMT2AGAAKDM4E
SCHEMBL14993903 0.77 BRD4 (0.38) GAAKDM4EALDH1A1BRD4BRD2
SCHEMBL1856897 0.77 HDAC8 (0.35) GAAKDM4EALDH1A1BRD4BRD2
SCHEMBL2114179 0.77 KDM4E (0.38) GAAKDM4EALDH1A1BRD4BRD2
SCHEMBL7257366 0.77 MEN1 (0.45) MEN1RAB9AKMT2AGAAKDM4E
SCHEMBL27295583 0.77 ACLY (0.43) MEN1RAB9AKMT2AGAAKDM4E
SCHEMBL19513805 0.77 MEN1 (0.41) MEN1RAB9AKMT2AGAAKDM4E
SCHEMBL14993737 0.77 AURKA (0.49) MEN1RAB9AKMT2AGAAKDM4E
SCHEMBL24923650 0.74 BRD4 (0.35) MEN1RAB9AKMT2AGAAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1304325-A1 5-(M-CYANOBENZYLAMINO)PYRAZOLE DERIVATIVES Sankyo Company, Limited (JP) 2003-04-23 EP claimed
US-8158652-B2 1-Difluoromethyl-5-{4-[3-(1-piperidinyl)propoxy]phenyl}-2(1H)-pyridone; compounds act as histamine-H3 receptor antagonistic substances or inverse-agonistic substances; useful as preventives or remedies for various circular system diseases, nervous system diseases, metabolic system diseases MSD K.K. (JP) 2012-04-17 US disclosed
US-20080269287-A1 Substituted Pyridone Derivative MSD K.K. (JP) 2008-10-30 US disclosed
EP-1820797-A1 SUBSTITUTED PYRIDONE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2007-08-22 EP disclosed
EP-1304325-A1 5-(M-CYANOBENZYLAMINO)PYRAZOLE DERIVATIVES Sankyo Company, Limited (JP) 2003-04-23 EP disclosed
WO-2001055113-A1 PROCESSES FOR DECHLORINATING PYRIDINES REILLY INDUSTRIES, INC. (US) 2001-08-02 WO disclosed
US-6051714-A DECHLORINATION OF CHLORINATED PYRIDINES WITH ZINC IN THE PRESENCE OF PHASE TRANSFER CATALYSTS AND ALKALINE REAGENTS REILLY INDUSTRIES, INC. (US) 2000-04-18 US disclosed
EP-0026736-B1 PROCESS FOR PREPARING 2,3,5-TRICHLOROPYRIDINE AND AMMONIUM SALTS OF THE METHYL ESTER OF METHANE PHOSPHONIC ACID, AND THEIR PREPARATION CIBA-GEIGY AG (CH) 1984-12-05 EP disclosed
EP-0040176-B1 PROCESS FOR THE PREPARATION OF 2,3,5-TRICHLOROPYRIDINE CIBA-GEIGY AG (CH) 1984-02-15 EP disclosed
US-4379938-A Process for producing 2,3,5-trichloropyridine CIBA-GEIGY CORPORATION (US) 1983-04-12 US disclosed
EP-0040176-A1 Process for the preparation of 2,3,5-trichloropyridine CIBA-GEIGY AG (CH) 1981-11-18 EP disclosed
US-4287347-A Process for producing 2,3,5-trichloropyridine CIBA-GEIGY CORPORATION (US) 1981-09-01 US disclosed
EP-0026736-A2 Process for preparing 2,3,5-trichloropyridine and ammonium salts of the methyl ester of methane phosphonic acid, and their preparation CIBA-GEIGY AG (CH) 1981-04-08 EP disclosed
US-4258194-A Process for producing 2,3,5-trichloropyridine CIBA-GEIGY CORPORATION (US) 1981-03-24 US disclosed
US-4245098-A BY REACTING TRICHLOROACETALDEHYDE WITH ACRYLONITRILE CIBA-GEIGY CORPORATION (US) 1981-01-13 US disclosed
EP-0012117-A1 Process for the preparation of 2,3,5-trichloropyridine; 2,4,4-trichloro-4-formyl-butyronitrile and process for its preparation CIBA-GEIGY AG (CH) 1980-06-11 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 (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-20080269287-A1 Substituted Pyridone Derivative HRH3, HRH4, HRH1 MEN1 1263/4885RAB9A 3851/4885KMT2A 394/4885

“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.