SCHEMBL10312259

SCHEMBL10312259

Cc1ccc(C(C)NS(C)(=O)=O)cc1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 14/20 0.51
ALDH1A1 P00352 1/20 0.49
CNR1 P21554 6/20 0.47
DRD4 P21917 1/20 0.47
DRD3 P35462 1/20 0.47
HTR6 P50406 1/20 0.47
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
ACHE P22303 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
SCHEMBL16338567 0.82 CNR2 (0.50) CNR2CNR1DRD4DRD3HTR6
SCHEMBL17394221 0.82 CNR2 (0.50) CNR2CNR1DRD4DRD3HTR6
SCHEMBL3990518 0.82 CNR2 (0.50) CNR2CNR1DRD4DRD3HTR6
SCHEMBL3990521 0.82 CNR2 (0.50) CNR2CNR1DRD4DRD3HTR6
SCHEMBL25547081 0.82 CA2 (0.66) ALDH1A1CNR1CA1CA2ACHE
SCHEMBL182775 0.81 CNR2 (0.57) CNR2ALDH1A1
SCHEMBL10080089 0.81 CNR2 (0.57) CNR2ALDH1A1
SCHEMBL3885828 0.81 CNR2 (0.57) CNR2ALDH1A1
SCHEMBL29259803 0.80 CNR1 (0.60) ALDH1A1CNR1CA1CA2
SCHEMBL9452678 0.79 ALDH1A1 (0.54) CNR2ALDH1A1CNR1DRD4DRD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120174324-A1 DYES FOR POLYMER COLORATION, THEIR PREPARATION AND THEIR USE DYSTAR COLOURS DEUTSCHLAND GMBH (DE) 2012-07-12 US disclosed
US-8067442-B2 Heterocyclic antiviral compounds ROCHE PALO ALTO LLC (US) 2011-11-29 US disclosed
US-20100081658-A1 HETEROCYCLIC ANTIVIRAL COMPOUNDS ROCHE PALO ALTO LLC 2010-04-01 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 (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-20120174324-A1 DYES FOR POLYMER COLORATION, THEIR PREPARATION AND THEIR USE IK, H1-0, H1-5 CNR2 2844/4885ALDH1A1 244/4885CNR1 1687/4885
US-20100081658-A1 HETEROCYCLIC ANTIVIRAL COMPOUNDS EIF2AK2, POLR2A, HCCS CNR2 1093/4885ALDH1A1 1038/4885CNR1 738/4885

“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.