SCHEMBL1775809

SCHEMBL1775809

Cc1c(Cl)c(C(F)(F)F)nn1C(C)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.46
RECQL P46063 1/20 0.46
CCR1 P32246 13/20 0.39
ALDH1A1 P00352 1/20 0.38
TDP1 Q9NUW8 1/20 0.36
NLRP3 Q96P20 1/20 0.33

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
SCHEMBL15491596 0.88 KDM4E (0.46) KDM4ERECQLCCR1TDP1NLRP3
SCHEMBL15484896 0.85 KDM4E (0.44) KDM4ERECQLCCR1TDP1NLRP3
SCHEMBL15492970 0.82 KDM4E (0.45) KDM4ERECQLCCR1ALDH1A1TDP1
SCHEMBL1119932 0.81 KDM4E (0.46) KDM4ERECQLCCR1ALDH1A1TDP1
SCHEMBL15491626 0.81 KDM4E (0.46) KDM4ERECQLCCR1ALDH1A1TDP1
SCHEMBL15491625 0.81 KDM4E (0.46) KDM4ERECQLCCR1ALDH1A1TDP1
SCHEMBL14015669 0.80 KDM4E (0.42) KDM4ERECQLCCR1TDP1NLRP3
SCHEMBL15779544 0.79 KDM4E (0.44) KDM4ERECQLCCR1ALDH1A1TDP1
SCHEMBL19965862 0.78 KDM4E (0.41) KDM4ERECQLCCR1TDP1NLRP3
SCHEMBL13024570 0.77 CCR1 (0.45) KDM4ERECQLCCR1ALDH1A1TDP1

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 41 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10342781-B2 Diazole amides CHEMOCENTRYX, INC. (US) 2019-07-09 US disclosed
US-10342781-B2 Diazole amides CHEMOCENTRYX, INC. (US) 2019-07-09 US disclosed
US-20180369213-A1 ANTAGONISTS OF CHEMOKINE RECEPTORS CHEMOCENTRYX, INC. 2018-12-27 US disclosed
EP-2888261-B1 ANTAGONISTS OF CHEMOKINE RECEPTORS CHEMOCENTRYX INC (US) 2018-04-18 EP disclosed
US-20180071257-A1 DIAZOLE AMIDES CHEMOCENTRYX, INC. 2018-03-15 US disclosed
US-20180071257-A1 DIAZOLE AMIDES CHEMOCENTRYX, INC. 2018-03-15 US disclosed
US-20180071257-A1 DIAZOLE AMIDES CHEMOCENTRYX, INC. 2018-03-15 US disclosed
EP-2935227-B1 DIAZOLE AMIDES AS CCR1 RECEPTOR ANTAGONISTS CHEMOCENTRYX INC (US) 2017-09-13 EP disclosed
EP-2935227-B1 DIAZOLE AMIDES AS CCR1 RECEPTOR ANTAGONISTS CHEMOCENTRYX INC (US) 2017-09-13 EP disclosed
US-9750722-B2 Diazole amides CHEMOCENTRYX, INC. (US) 2017-09-05 US disclosed
US-20140179733-A1 DIAZOLE AMIDES CHEMOCENTRYX, INC. (US) 2014-06-26 US disclosed
WO-2014035967-A2 ANTAGONISTS OF CHEMOKINE RECEPTORS CHEMOCENTRYX, INC. (US) 2014-03-06 WO disclosed
US-20140057937-A1 ANTAGONISTS OF CHEMOKINE RECEPTORS CHEMOCENTRYX, INC. (US) 2014-02-27 US disclosed
US-20140057937-A1 ANTAGONISTS OF CHEMOKINE RECEPTORS CHEMOCENTRYX, INC. (US) 2014-02-27 US disclosed
US-20140057937-A1 ANTAGONISTS OF CHEMOKINE RECEPTORS CHEMOCENTRYX, INC. (US) 2014-02-27 US disclosed
CN-102216296-A Heterocyclyl-substituted thiazoles as plant protection agents BAYER CROPSCIENCE AG 2011-10-12 CN disclosed
EP-2334669-A1 HETEROCYCLYL-SUBSTITUTED THIAZOLES AS PLANT PROTECTION AGENTS Bayer CropScience AG (DE) 2011-06-22 EP disclosed
US-7943774-B2 Heterocyclyl-substituted thiazoles as crop protection agents BAYER CROPSCIENCE AG (DE) 2011-05-17 US disclosed
US-20100137245-A1 Heteerocyclyl-substituted thiazoles as crop protection agents BAYER CROPSCIENCE AG (DE) 2010-06-03 US disclosed
WO-2010037479-A1 HETEROCYCLYL-SUBSTITUTED THIAZOLES AS PLANT PROTECTION AGENTS BAYER CROPSCIENCE AG (DE) 2010-04-08 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 (6 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-20180071257-A1 DIAZOLE AMIDES CCR1, CCRL2, CCR4 KDM4E 3623/4885RECQL 2677/4885CCR1 1/4885
US-20180369213-A1 ANTAGONISTS OF CHEMOKINE RECEPTORS CCR1, CCR3, CCR2 KDM4E 4682/4885RECQL 4014/4885CCR1 1/4885
US-10342781-B2 Diazole amides CCR1, CCRL2, CCR4 KDM4E 3623/4885RECQL 2677/4885CCR1 1/4885
US-20140179733-A1 DIAZOLE AMIDES CCR1, CCRL2, CCR4 KDM4E 3623/4885RECQL 2677/4885CCR1 1/4885
US-20100137245-A1 Heteerocyclyl-substituted thiazoles as crop protection agents CYP8B1, CYP51A1, HPD KDM4E 3603/4885RECQL 2011/4885CCR1 2946/4885
US-20140057937-A1 ANTAGONISTS OF CHEMOKINE RECEPTORS CCR1, CCR3, CCR2 KDM4E 4682/4885RECQL 4014/4885CCR1 1/4885

“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.