SCHEMBL1303201

SCHEMBL1303201

CC(C(=O)O)c1cc(O)n(-c2ccc(F)cc2Cl)n1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MARS1 P56192 1/20 0.43
CHRM1 P11229 1/20 0.40
PTGS1 P23219 1/20 0.40
LMNA P02545 1/20 0.37
KMT2A Q03164 1/20 0.37
NR3C2 P08235 1/20 0.36
TRPV1 Q8NER1 1/20 0.36
CNR1 P21554 5/20 0.35
CNR2 P34972 4/20 0.35
AR P10275 1/20 0.35
P2RX7 Q99572 1/20 0.35
MAPK14 Q16539 1/20 0.35

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
SCHEMBL1302690 0.83 ALDH1A1 (0.40) CHRM1PTGS1KMT2ACNR1
SCHEMBL3250915 0.75 MARS1 (0.39) MARS1LMNANR3C2CNR1CNR2
SCHEMBL2846887 0.75 MARS1 (0.41) MARS1LMNAKMT2ANR3C2P2RX7
SCHEMBL1303913 0.72 CHRM1 (0.35) MARS1CHRM1PTGS1LMNAKMT2A
SCHEMBL1722410 0.72 P2RX7 (0.39) MARS1KMT2ANR3C2CNR1P2RX7
SCHEMBL564412 0.70 MDM2 (0.44) PTGS1NR3C2
SCHEMBL28575589 0.68 L3MBTL1 (0.40) CNR1CNR2
SCHEMBL24875683 0.68 PSEN1 (0.48) CHRM1PTGS1KMT2A
SCHEMBL30192806 0.68 PSEN1 (0.48) CHRM1PTGS1KMT2A
SCHEMBL20550778 0.67 LMNA (0.57) MARS1LMNANR3C2ARP2RX7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110269757-A1 PYRAZOLO PYRIDINE DERIVATIVES AS NADPH OXIDASE INHIBITORS GENKYOTEX SA (CH) 2011-11-03 US disclosed
EP-2344492-A1 PYRAZOLO PYRIDINE DERIVATIVES AS NADPH OXIDASE INHIBITORS GenKyoTex SA (CH) 2011-07-20 EP 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-20110269757-A1 PYRAZOLO PYRIDINE DERIVATIVES AS NADPH OXIDASE INHIBITORS NOX1, NOX4, CYBB MARS1 3708/4885CHRM1 1157/4885PTGS1 251/4885

“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.