SCHEMBL2986016

SCHEMBL2986016

Cc1c(Cl)cccc1NC(=O)CN

nearest known ligand 0.67

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.67
MAPT P10636 2/20 0.67
LMNA P02545 3/20 0.64
HPGD P15428 1/20 0.64
MAPK1 P28482 1/20 0.64
KDM4E B2RXH2 3/20 0.62
THRB P10828 1/20 0.62
POLB P06746 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
KMT2A Q03164 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
HSD17B10 Q99714 1/20 0.56
AGER Q15109 1/20 0.54

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
SCHEMBL11577296 0.87 LMNA (0.64) ALDH1A1MAPTLMNAHPGDMAPK1
SCHEMBL29678332 0.85 LMNA (0.66) ALDH1A1MAPTLMNAHPGDMAPK1
SCHEMBL4003436 0.85 LMNA (0.66) ALDH1A1MAPTLMNAHPGDMAPK1
SCHEMBL14085811 0.85 ALDH1A1 (0.67) ALDH1A1MAPTLMNAHPGDMAPK1
SCHEMBL4210079 0.83 LMNA (0.64) ALDH1A1MAPTLMNAHPGDMAPK1
SCHEMBL28947962 0.83 MAPT (0.65) ALDH1A1MAPTLMNAHPGDMAPK1
SCHEMBL15684207 0.83 KDM4E (0.70) ALDH1A1MAPTLMNAHPGDMAPK1
SCHEMBL2169180 0.82 MEN1 (0.68) HPGDKDM4EPOLBKMT2A
SCHEMBL8334831 0.81 KDM4E (0.69) ALDH1A1MAPTLMNAHPGDMAPK1
SCHEMBL2093177 0.80 MAPT (0.71) ALDH1A1MAPTLMNAHPGDMAPK1

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
US-7790726-B2 Monocyclic and bicyclic compounds and methods of use CHEMOCENTRYX, INC. (US) 2010-09-07 US disclosed
US-7790726-B2 Monocyclic and bicyclic compounds and methods of use CHEMOCENTRYX, INC. (US) 2010-09-07 US disclosed
US-7790726-B2 Monocyclic and bicyclic compounds and methods of use CHEMOCENTRYX, INC. (US) 2010-09-07 US disclosed
US-7786157-B2 OXO-imidazolidines as modulators of chemokine receptors CHEMOCENTRYX, INC. (US) 2010-08-31 US disclosed
US-7786157-B2 OXO-imidazolidines as modulators of chemokine receptors CHEMOCENTRYX, INC. (US) 2010-08-31 US disclosed
US-7786157-B2 OXO-imidazolidines as modulators of chemokine receptors CHEMOCENTRYX, INC. (US) 2010-08-31 US disclosed
EP-1931348-A4 MONOCYCLIC AND BICYCLIC COMPOUNDS AND METHODS OF USE CHEMOCENTRYX INC (US) 2009-08-12 EP disclosed
US-20080269280-A1 OXO-IMIDAZOLIDINES AS MODULATORS OF CHEMOKINE RECEPTORS CHEMOCENTRYX, INC. (US) 2008-10-30 US disclosed
US-20080269280-A1 OXO-IMIDAZOLIDINES AS MODULATORS OF CHEMOKINE RECEPTORS CHEMOCENTRYX, INC. (US) 2008-10-30 US disclosed
US-20080269280-A1 OXO-IMIDAZOLIDINES AS MODULATORS OF CHEMOKINE RECEPTORS CHEMOCENTRYX, INC. (US) 2008-10-30 US disclosed
EP-1931348-A2 MONOCYCLIC AND BICYCLIC COMPOUNDS AND METHODS OF USE ChemoCentryx Inc (US) 2008-06-18 EP disclosed
US-20070066583-A1 Monocyclic and bicyclic compounds and methods of use CHEMOCENTRYX, INC. (US) 2007-03-22 US disclosed
US-20070066583-A1 Monocyclic and bicyclic compounds and methods of use CHEMOCENTRYX, INC. (US) 2007-03-22 US disclosed
US-20070066583-A1 Monocyclic and bicyclic compounds and methods of use CHEMOCENTRYX, INC. (US) 2007-03-22 US disclosed
WO-2007022257-A2 MONOCYCLIC AND BICYCLIC COMPOUNDS AND METHODS OF USE CHEMOCENTRYX, INC. (US) 2007-02-22 WO disclosed
WO-2007022257-A2 MONOCYCLIC AND BICYCLIC COMPOUNDS AND METHODS OF USE CHEMOCENTRYX, INC. (US) 2007-02-22 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 (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-20070066583-A1 Monocyclic and bicyclic compounds and methods of use CCR1, CCR3, CCR4 ALDH1A1 1533/4885MAPT 3597/4885LMNA 2708/4885
US-20080269280-A1 OXO-IMIDAZOLIDINES AS MODULATORS OF CHEMOKINE RECEPTORS CCR1, CCR3, CCR4 ALDH1A1 2544/4885MAPT 4486/4885LMNA 4587/4885

“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.