SCHEMBL1986571

SCHEMBL1986571

Cc1csc(-c2c(C)c(C(=O)O)nn2-c2ccc(Cl)cc2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.46
HIF1A Q16665 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.44
PPP1CA P62136 1/20 0.44
CNR1 P21554 2/20 0.43
PTGS2 P35354 2/20 0.43
ALDH1A1 P00352 1/20 0.41
RPA1 P27694 1/20 0.40
PPARG P37231 1/20 0.39
PPARA Q07869 1/20 0.39
MAPT P10636 3/20 0.39
APP P05067 1/20 0.39
CASP1 P29466 1/20 0.39
KDM4E B2RXH2 1/20 0.38
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CNR2 P34972 2/20 0.38

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
SCHEMBL1984616 0.92 CYP1A2 (0.46) CYP1A2HIF1ASMN1; SMN2PPP1CACNR1
SCHEMBL1983441 0.89 CYP1A2 (0.45) CYP1A2HIF1ASMN1; SMN2PPP1CACNR1
SCHEMBL1987131 0.86 MAPT (0.42) CYP1A2HIF1ASMN1; SMN2PPP1CACNR1
SCHEMBL1982830 0.86 MAPT (0.49) ALDH1A1RPA1MAPTAPPKDM4E
SCHEMBL1987372 0.85 CNR2 (0.53) CNR1CNR2
SCHEMBL1986572 0.83 SMN1; SMN2 (0.39) SMN1; SMN2PPP1CACNR1RPA1MAPT
SCHEMBL1984826 0.82 MAPT (0.47) CYP1A2PTGS2ALDH1A1RPA1MAPT
SCHEMBL1983556 0.81 CYP1A2 (0.48) CYP1A2HIF1ASMN1; SMN2PPP1CACNR1
SCHEMBL1985488 0.81 CNR1 (0.50) CYP1A2HIF1ASMN1; SMN2PPP1CACNR1
SCHEMBL277784 0.79 CNR1 (0.62) CYP1A2HIF1ASMN1; SMN2PPP1CACNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1602656-B1 PYRAZOLE DERIVATIVES HAVING AFFINITY FOR CB1 AND/OR CB2 RECEPTORS NEUROSCIENZE PHARMANESS S C A R L (IT) 2011-06-29 EP claimed
EP-1602656-A1 PYRAZOLE DERIVATIVES HAVING AFFINITY FOR CB1 AND/OR CB2 RECEPTORS NEUROSCIENZE PHARMANESS S.C. a R.L. (IT) 2005-12-07 EP claimed
US-20050261281-A1 Pharmaceutical compounds MIDCAP FUNDING III, LLC 2005-11-24 US claimed
US-8227620-B2 Pharmaceutical compounds NEUROSCIENZE PHARMANESS S.C. A.R.L. (IT) 2012-07-24 US disclosed
EP-1602656-B1 PYRAZOLE DERIVATIVES HAVING AFFINITY FOR CB1 AND/OR CB2 RECEPTORS NEUROSCIENZE PHARMANESS S C A R L (IT) 2011-06-29 EP disclosed
US-20100105896-A1 PHARMACEUTICAL COMPOUNDS Neuroscienze Pharmaness S.C.a.R.I. (IT) 2010-04-29 US disclosed
US-7659407-B2 pyrazole derivatives having affinity for cannabinoidergic CB1 and/or CB2 receptors; immune disorders, osteoporosis, renal ischemia, inflammation,transplant rejection; 5-(5-Chloro-thiofen-2-yl)-1-(4-methoxy-phenyl)-4-methyl-1H-pyrazol-3-carboxylic acid Neuroscienze Pharmaness S.C.a.R.I. (IT) 2010-02-09 US disclosed
EP-1602656-A1 PYRAZOLE DERIVATIVES HAVING AFFINITY FOR CB1 AND/OR CB2 RECEPTORS NEUROSCIENZE PHARMANESS S.C. a R.L. (IT) 2005-12-07 EP disclosed
US-20050261281-A1 Pharmaceutical compounds MIDCAP FUNDING III, LLC 2005-11-24 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-20100105896-A1 PHARMACEUTICAL COMPOUNDS CNR1, CNR2, OPRD1 CYP1A2 129/4885HIF1A 2240/4885SMN1; SMN2 4836/4885
US-20050261281-A1 Pharmaceutical compounds CNR1, CNR2, OPRD1 CYP1A2 207/4885HIF1A 1502/4885SMN1; SMN2 4767/4885

“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.