SCHEMBL1127347

SCHEMBL1127347

COCCn1cc(-c2ccccc2)cc1C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 3/20 0.50
CNR2 P34972 4/20 0.46
GLO1 Q04760 2/20 0.42
CCNC P24863 1/20 0.39
CDK8 P49336 1/20 0.39
ALDH1A1 P00352 2/20 0.39
CALCRL Q16602 1/20 0.38
USP2 O75604 1/20 0.38
NR4A2 P43354 1/20 0.37
ATM Q13315 1/20 0.37
CECR2 Q9BXF3 1/20 0.37
CYP2C19 P33261 1/20 0.37
LMNA P02545 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
HPGD P15428 1/20 0.37

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
SCHEMBL1126514 0.87 ALDH1A1 (0.41) CNR1CNR2ALDH1A1HPGD
SCHEMBL1126651 0.87 CNR1 (0.45) CNR1CNR2ALDH1A1HPGD
SCHEMBL1126536 0.85 CNR1 (0.46) CNR1CNR2ALDH1A1CYP2C19LMNA
SCHEMBL1127225 0.85 CCNC (0.41) CNR1CCNCCDK8ALDH1A1NR4A2
SCHEMBL1988373 0.84 CNR1 (0.44) CNR1CNR2ALDH1A1ATMCYP2C19
SCHEMBL1126490 0.80 CNR1 (0.42) CNR1CNR2ALDH1A1HPGD
SCHEMBL2834581 0.80 CCNC (0.43) CCNCCDK8ALDH1A1HPGD
SCHEMBL1126990 0.78 CNR1 (0.45) CNR1CNR2GLO1ALDH1A1CALCRL
SCHEMBL1127178 0.77 CNR1 (0.44) CNR1CNR2GLO1ALDH1A1CALCRL
SCHEMBL1126860 0.76 CNR1 (0.43) CNR1CNR2GLO1ALDH1A1CALCRL

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
US-9452168-B2 Pyrrole antifungal agents F2G LTD (GB) 2016-09-27 US disclosed
US-20150238500-A1 PYRROLE ANTIFUNGAL AGENTS F2G LTD (GB) 2015-08-27 US disclosed
US-8993574-B2 Pyrrole antifungal agents F2G LTD (GB) 2015-03-31 US disclosed
EP-2283006-B1 PYRROLE ANTIFUNGAL AGENTS F2G LTD (GB) 2015-02-25 EP disclosed
EP-2626361-B1 Pyrrole antifungal agents F2G LTD (GB) 2014-10-15 EP disclosed
EP-2626361-A1 Pyrrole antifungal agents F2G Limited (GB) 2013-08-14 EP disclosed
US-20110152285-A1 PYRROLE ANTIFUNGAL AGENTS F2G LTD (GB) 2011-06-23 US disclosed
EP-2283006-A1 PYRROLE ANTIFUNGAL AGENTS F2G Limited (GB) 2011-02-16 EP disclosed
WO-2009130481-A1 PYRROLE ANTIFUNGAL AGENTS F2G LTD (GB) 2009-10-29 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 (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-20110152285-A1 PYRROLE ANTIFUNGAL AGENTS FOXM1, PYCR1, ARG1 CNR1 1131/4885CNR2 3554/4885GLO1 113/4885
US-20150238500-A1 PYRROLE ANTIFUNGAL AGENTS FOXM1, PYCR1, ARG1 CNR1 1131/4885CNR2 3554/4885GLO1 113/4885

“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.