SCHEMBL393739

SCHEMBL393739

[NH]NC(=O)c1ccc(Cl)cc1Cl

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.69
MAPT P10636 1/20 0.69
SMN1; SMN2 Q16637 3/20 0.61
TSHR P16473 1/20 0.61
CASP1 P29466 1/20 0.61
POLB P06746 3/20 0.59
ALDH1A1 P00352 3/20 0.59
THRB P10828 1/20 0.59
RECQL P46063 1/20 0.59
TDP1 Q9NUW8 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
FLT1 P17948 4/20 0.57
FLT4 P35916 4/20 0.57
KDR P35968 4/20 0.57
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
JAK2 O60674 1/20 0.57
JAK1 P23458 1/20 0.57
TYK2 P29597 1/20 0.57
HPGD P15428 1/20 0.57

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
SCHEMBL11419345 0.85 ALDH1A1 (0.77) KDM4EMAPTSMN1; SMN2TSHRCASP1
SCHEMBL6790469 0.83 KDM4E (0.69) KDM4EMAPTSMN1; SMN2TSHRCASP1
SCHEMBL9782403 0.82 KDM4E (0.62) KDM4EMAPTSMN1; SMN2TSHRCASP1
SCHEMBL1127878 0.82 KDM4E (1.00) KDM4EMAPTSMN1; SMN2TSHRCASP1
SCHEMBL6971076 0.82 KDM4E (0.67) KDM4EMAPTSMN1; SMN2TSHRCASP1
SCHEMBL4154496 0.82 KDM4E (0.67) KDM4EMAPTSMN1; SMN2TSHRCASP1
SCHEMBL29833777 0.82 KDM4E (0.67) KDM4EMAPTSMN1; SMN2TSHRCASP1
Hydrochloric Acid SCHEMBL21381943 0.80 KDM4E (0.96) KDM4EMAPTSMN1; SMN2TSHRCASP1
SCHEMBL13479741 0.80 MAPT (0.64) KDM4EMAPTSMN1; SMN2TSHRCASP1
SCHEMBL1514676 0.79 KDM4E (0.68) KDM4EMAPTSMN1; SMN2TSHRCASP1

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
EP-1931335-B1 HEXAHYDRO CYCLOOCTYL PYRAZOLE CANNABINOID MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2010-02-24 EP claimed
EP-1863479-B1 TETRAHYDROTHIOPYRANO PYRAZOLE CANNABINOID MODULATORS CROSS REFERENCE TO RELATED APPLICATIONS JANSSEN PHARMACEUTICA NV (BE) 2008-12-10 EP claimed
US-8101592-B2 Hexahydro-cyclooctyl pyrazole cannabinoid modulators JANSSEN PHARMACEUTICA N.V. (BG) 2012-01-24 US disclosed
EP-1863479-A1 TETRAHYDROTHIOPYRANO PYRAZOLE CANNABINOID MODULATORS CROSS REFERENCE TO RELATED APPLICATIONS JANSSEN PHARMACEUTICA N.V. (BE) 2007-12-12 EP disclosed
WO-2006107561-A1 TETRAHYDROTHIOPYRANO PYRAZOLE CANNABINOID MODULATORS JANSSEN PHARMACEUTICA, N.V. (BE) 2006-10-12 WO disclosed
US-20060223798-A1 Tetrahydrothiopyrano pyrazole cannabinoid modulators JANSSEN PHARMACEUTICA NV (BE) 2006-10-05 US 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-20060223798-A1 Tetrahydrothiopyrano pyrazole cannabinoid modulators CNR1, CNR2, GPR18 KDM4E 2507/4885MAPT 1971/4885SMN1; SMN2 3875/4885

“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.