SCHEMBL1126534

SCHEMBL1126534

CCOC(=O)C=CC1CCC1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.48
L3MBTL1 Q9Y468 3/20 0.42
MAPT P10636 2/20 0.41
TDP1 Q9NUW8 1/20 0.40
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39
CA14 Q9ULX7 1/20 0.39
NPSR1 Q6W5P4 1/20 0.38
ALDH1A1 P00352 3/20 0.37
LMNA P02545 2/20 0.36
TTR P02766 1/20 0.36
DPP4 P27487 1/20 0.36
ATM Q13315 1/20 0.35
ESR2 Q92731 1/20 0.35
MDM2 Q00987 1/20 0.34

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
SCHEMBL1126533 1.00 HCAR2 (0.48) HCAR2L3MBTL1MAPTTDP1CA12
SCHEMBL425749 0.96 HCAR2 (0.48) HCAR2L3MBTL1MAPTTDP1CA12
SCHEMBL425748 0.96 HCAR2 (0.48) HCAR2L3MBTL1MAPTTDP1CA12
SCHEMBL9744705 0.94 HCAR2 (0.47) HCAR2L3MBTL1MAPTTDP1CA12
SCHEMBL14363086 0.94 HCAR2 (0.47) HCAR2L3MBTL1MAPTTDP1CA12
SCHEMBL1581948 0.94 HCAR2 (0.47) HCAR2L3MBTL1MAPTTDP1CA12
SCHEMBL1581950 0.94 HCAR2 (0.47) HCAR2L3MBTL1MAPTTDP1CA12
SCHEMBL9744701 0.94 HCAR2 (0.47) HCAR2L3MBTL1MAPTTDP1CA12
SCHEMBL7512241 0.92 HCAR2 (0.52) HCAR2L3MBTL1MAPTTDP1CA12
SCHEMBL7512242 0.92 HCAR2 (0.52) HCAR2L3MBTL1MAPTTDP1CA12

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 13 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
US-4551476-A 13,14-Didehydro-prostaglandins and process for their preparation FARMITALIA CARLO ERBA S.P.A. (IT) 1985-11-05 US disclosed
US-4361577-A ANTIULCER AND LUTEOLYTIC AGENTS CARLO ERBA - S.P.A. (IT) 1982-11-30 US disclosed
US-4169145-A ANTIULCER AGENTS, LUTEOLYTIC ABORTIFACIENTS, OXYTOCICS CARLO ERBA S.P.A. (IT) 1979-09-25 US disclosed
US-4035415-A GASTROINTESTINAL DISORDERS CARLO ERBA, S.P.A. (IT) 1977-07-12 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 HCAR2 2767/4885L3MBTL1 1045/4885MAPT 1696/4885
US-20150238500-A1 PYRROLE ANTIFUNGAL AGENTS FOXM1, PYCR1, ARG1 HCAR2 2767/4885L3MBTL1 1045/4885MAPT 1696/4885

“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.