SCHEMBL212260

SCHEMBL212260

CN(C(=O)NCc1cccc(F)c1Cl)C(CCC(=O)N1CCNCC1)COC(=O)Nc1cc(-c2cccc(F)c2)no1

nearest known ligand 0.32

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.32
MAPT P10636 2/20 0.32
USP30 Q70CQ3 6/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
HTR2C P28335 1/20 0.31
HTR2B P41595 1/20 0.31
FAAH O00519 1/20 0.30
MAPK1 P28482 1/20 0.30
GHSR Q92847 1/20 0.30
CHRM3 P20309 2/20 0.30

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
SCHEMBL212258 1.00 EPHX2 (0.32) EPHX2MAPTUSP30KDM4EALDH1A1
SCHEMBL212259 1.00 EPHX2 (0.32) EPHX2MAPTUSP30KDM4EALDH1A1
SCHEMBL2724845 0.95 MAPT (0.36) MAPTUSP30HTR2CHTR2B
SCHEMBL2758955 0.93 FAAH (0.33) EPHX2MAPTUSP30KDM4EALDH1A1
SCHEMBL4355654 0.93 MAPT (0.34) EPHX2MAPTUSP30KDM4EALDH1A1
SCHEMBL2725335 0.93 CHRM3 (0.33) EPHX2MAPTUSP30FAAHMAPK1
SCHEMBL2725297 0.93 MAPT (0.34) MAPTUSP30LMNAHTR2CHTR2B
SCHEMBL2725975 0.93 MAPT (0.32) EPHX2MAPTUSP30FAAHMAPK1
SCHEMBL214458 0.90 GPR119 (0.34) MAPTFAAH
SCHEMBL210350 0.90 GPR119 (0.34) MAPTFAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8895582-B2 Certain chemical entities, compositions, and methods CYTOKINETICS, INC. (US) 2014-11-25 US disclosed
US-8759374-B2 Certain chemical entities, compositions, and methods CYTOKINETICS, INC. (US) 2014-06-24 US disclosed
US-20130053348-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS QIAN XIANGPING (US) 2013-02-28 US disclosed
US-20120135964-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS QIAN XIANGPING (US) 2012-05-31 US disclosed
US-8088793-B2 Certain chemical entities, compositions, and methods CYTOKINETICS, INC. (US) 2012-01-03 US disclosed
EP-2195328-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS Cytokinetics, Incorporated (US) 2010-06-16 EP disclosed
US-20090275537-A1 Certain chemical entities, compositions, and methods CYTOKINETICS, INC. 2009-11-05 US disclosed
WO-2009023193-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS CYTOKINETICS, INCORPORATED (US) 2009-02-19 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 (3 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-20090275537-A1 Certain chemical entities, compositions, and methods MYLK, MYH2, MYH10 EPHX2 2051/4885MAPT 530/4885USP30 2381/4885
US-20120135964-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS MYLK, MYH2, MYH10 EPHX2 2051/4885MAPT 530/4885USP30 2381/4885
US-20130053348-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS MYLK, MYH2, MYH10 EPHX2 2051/4885MAPT 530/4885USP30 2381/4885

“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.