SCHEMBL1984541

SCHEMBL1984541

Cc1c(C(=O)O)nn(-c2ccc(Cl)cc2)c1-c1cc(Br)co1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.44
HIF1A Q16665 1/20 0.44
POLB P06746 2/20 0.43
MEN1 O00255 1/20 0.43
RECQL P46063 1/20 0.43
CACNA1B Q00975 1/20 0.43
APBA1 Q02410 1/20 0.43
KMT2A Q03164 1/20 0.43
MCL1 Q07820 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
CNR1 P21554 4/20 0.42
PTGS2 P35354 2/20 0.42
SMN1; SMN2 Q16637 3/20 0.40
PPP1CA P62136 1/20 0.40
CNR2 P34972 3/20 0.39
ALDH1A1 P00352 2/20 0.39
MAPT P10636 2/20 0.39
PKM P14618 1/20 0.39
HPGD P15428 1/20 0.39

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
SCHEMBL1984324 0.90 CYP1A2 (0.46) CYP1A2HIF1APOLBMEN1RECQL
SCHEMBL1989077 0.88 CYP1A2 (0.46) CYP1A2HIF1APOLBMEN1RECQL
SCHEMBL1987267 0.87 TP53 (0.46) RECQLL3MBTL1CNR1PTGS2CNR2
SCHEMBL1985791 0.86 CYP1A2 (0.42) CYP1A2HIF1APOLBMEN1RECQL
SCHEMBL1987186 0.86 CNR2 (0.53) CNR1CNR2
SCHEMBL1986817 0.81 CYP1A2 (0.46) CYP1A2HIF1APOLBMEN1RECQL
SCHEMBL1988013 0.80 TP53 (0.46) CYP1A2RECQLL3MBTL1PTGS2ALDH1A1
SCHEMBL1985122 0.79 CYP1A2 (0.47) CYP1A2HIF1APOLBMEN1RECQL
SCHEMBL1986567 0.79 CYP1A2 (0.47) CYP1A2HIF1APOLBMEN1RECQL
SCHEMBL1983441 0.78 CYP1A2 (0.45) CYP1A2HIF1ACNR1PTGS2SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 2240/4885POLB 4608/4885
US-20050261281-A1 Pharmaceutical compounds CNR1, CNR2, OPRD1 CYP1A2 207/4885HIF1A 1502/4885POLB 3824/4885

“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.