SCHEMBL342843

SCHEMBL342843

O=C(O)CNC(=O)c1ccc(F)c(F)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.56
MAPT P10636 1/20 0.56
HIF1A Q16665 1/20 0.56
SLC22A6 Q4U2R8 1/20 0.56
SLC22A8 Q8TCC7 1/20 0.56
MAPK1 P28482 1/20 0.54
PTPRC P08575 2/20 0.53
CTSL P07711 1/20 0.53
PTPN13 Q12923 1/20 0.53
CES2 O00748 1/20 0.52
CES1 P23141 1/20 0.52
ATM Q13315 1/20 0.51
USP5 P45974 2/20 0.51
CA1 P00915 2/20 0.50
CA2 P00918 2/20 0.50
KCNQ3 O43525 2/20 0.45
KCNQ2 O43526 2/20 0.45
KCNQ5 Q9NR82 1/20 0.45
ALDH1A1 P00352 1/20 0.44
HPGD P15428 1/20 0.44

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
SCHEMBL29195031 0.86 KDM4E (0.53) KDM4EMAPTHIF1ASLC22A6SLC22A8
SCHEMBL15631001 0.85 KDM4E (0.51) KDM4EMAPTHIF1ASLC22A6SLC22A8
SCHEMBL15630979 0.85 HDAC1 (0.63) KDM4EMAPTHIF1ASLC22A6SLC22A8
SCHEMBL15630994 0.85 KDM4E (0.60) KDM4EMAPTHIF1ASLC22A6SLC22A8
SCHEMBL15631041 0.85 HDAC1 (0.63) KDM4EMAPTHIF1ASLC22A6SLC22A8
SCHEMBL15631034 0.85 KDM4E (0.60) KDM4EMAPTHIF1ASLC22A6SLC22A8
SCHEMBL15610485 0.85 HDAC1 (0.63) KDM4EMAPTHIF1ASLC22A6SLC22A8
SCHEMBL15631040 0.85 HDAC1 (0.63) KDM4EMAPTHIF1ASLC22A6SLC22A8
SCHEMBL15630983 0.85 HDAC1 (0.63) KDM4EMAPTHIF1ASLC22A6SLC22A8
SCHEMBL15610634 0.85 KDM4E (0.60) KDM4EMAPTHIF1ASLC22A6SLC22A8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8835422-B2 Substituted imidazoheterocycle derivatives CARA THERAPEUTICS, INC. (US) 2014-09-16 US disclosed
US-8835422-B2 Substituted imidazoheterocycle derivatives CARA THERAPEUTICS, INC. (US) 2014-09-16 US disclosed
US-20120015930-A1 SUBSTITUTED IMIDAZOHETEROCYCLE DERIVATIVES CARA THERAPEUTICS, INC. (US) 2012-01-19 US disclosed
US-20120015930-A1 SUBSTITUTED IMIDAZOHETEROCYCLE DERIVATIVES CARA THERAPEUTICS, INC. (US) 2012-01-19 US disclosed
WO-2010068520-A2 SUBSTITUTED IMIDAZOHETEROCYCLE DERIVATIVES CARA THERAPEUTICS, INC. (US) 2010-06-17 WO disclosed
WO-2010068520-A2 SUBSTITUTED IMIDAZOHETEROCYCLE DERIVATIVES CARA THERAPEUTICS, INC. (US) 2010-06-17 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-20120015930-A1 SUBSTITUTED IMIDAZOHETEROCYCLE DERIVATIVES CNR1, CNR2, HRH1 KDM4E 3459/4885MAPT 2962/4885HIF1A 2113/4885

“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.