SCHEMBL1994058

SCHEMBL1994058

CCCc1c(C(=O)O)c(-c2ccccc2)c(C(=O)O)n1C

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GRIA4 P48058 19/20 0.53
GRIA2 P42262 17/20 0.53
PTGES O14684 1/20 0.43

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
SCHEMBL1126797 0.88 GRIA4 (0.63) GRIA4GRIA2
SCHEMBL1126733 0.85 GRIA4 (0.47) GRIA4GRIA2
SCHEMBL1126962 0.80 TSHR (0.53)
SCHEMBL1127287 0.76 GRIA4 (0.60) GRIA4GRIA2PTGES
SCHEMBL10463651 0.74 HPGD (0.49)
SCHEMBL1127427 0.73 KDM4E (0.45) GRIA4GRIA2PTGES
SCHEMBL8289864 0.73 GRIA4 (0.67) GRIA4GRIA2
SCHEMBL10462930 0.73 HPGD (0.48)
SCHEMBL1126774 0.73 GRIA4 (0.46) GRIA4GRIA2
SCHEMBL1127403 0.71 MEN1 (0.49) GRIA4GRIA2PTGES

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 7 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

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 GRIA4 2979/4885GRIA2 2791/4885PTGES 3853/4885
US-20150238500-A1 PYRROLE ANTIFUNGAL AGENTS FOXM1, PYCR1, ARG1 GRIA4 2979/4885GRIA2 2791/4885PTGES 3853/4885

“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.