SCHEMBL5037401

SCHEMBL5037401

O=C(NN1CCOCC1)c1nc(-c2cc(Cl)ccc2Cl)c(-c2ccccc2)s1

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 7/20 0.61
CNR2 P34972 6/20 0.61
POLB P06746 2/20 0.47
RORC P51449 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.45
CCNA2 P20248 2/20 0.43
CDK2 P24941 2/20 0.43
CCNA1 P78396 2/20 0.43
CDK5 Q00535 2/20 0.43
CDK5R1 Q15078 2/20 0.43
MTOR P42345 1/20 0.42
PTGS2 P35354 1/20 0.42
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
ALDH1A1 P00352 1/20 0.40
GAA P10253 1/20 0.40
HPGD P15428 1/20 0.40

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
SCHEMBL5037332 0.86 CNR1 (0.81) CNR1CNR2SMN1; SMN2KDM4EMEN1
SCHEMBL5038525 0.81 CNR1 (0.69) CNR1CNR2SMN1; SMN2KDM4EMEN1
SCHEMBL5038475 0.76 CNR1 (0.98) CNR1CNR2
SCHEMBL5043652 0.76 CNR1 (0.50) CNR1CNR2MEN1KMT2A
SCHEMBL675014 0.76 CNR1 (1.00) CNR1CNR2
SCHEMBL5041587 0.76 CNR1 (1.00) CNR1CNR2
SCHEMBL6190763 0.74 CNR1 (0.85) CNR1CNR2
SCHEMBL1250874 0.73 CNR1 (0.57) CNR1CNR2RORCSMN1; SMN2CDK2
SCHEMBL5043843 0.72 CNR1 (0.89) CNR1CNR2
SCHEMBL5036931 0.72 CNR1 (0.89) CNR1CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7342032-B2 Thiazole derivatives having CB1-antagonistic, agonistic or partial agonistic activity SOLVAY PHARMACEUTICALS, INC. (NL) 2008-03-11 US disclosed
EP-1492779-A1 THIAZOLE DERIVATIVES HAVING CB1-ANTAGONISTIC, AGONISTIC OR PARTIAL AGONISTIC ACTIVITY Solvay Pharmaceuticals B.V. (NL) 2005-01-05 EP disclosed
US-20040266841-A1 Thiazole derivatives having cb1-antagonistic, agonistic or partial agonistic activity ABBVIE B.V. (NL) 2004-12-30 US disclosed
WO-2003078413-A1 THIAZOLE DERIVATIVES HAVING CB1-ANTAGONISTIC, AGONISTIC OR PARTIAL AGONISTIC ACTIVITY SOLVAY PHARMACEUTICALS B.V. (NL) 2003-09-25 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-20040266841-A1 Thiazole derivatives having cb1-antagonistic, agonistic or partial agonistic activity CNR1, CNR2, CCKAR CNR1 1/4885CNR2 2/4885POLB 4805/4885

“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.