SCHEMBL1126535

SCHEMBL1126535

COCC=CCn1c(C)c(C(=O)O)c(-c2ccccc2)c1C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 4/20 0.43
AKT1 P31749 1/20 0.39
LOXL2 Q9Y4K0 1/20 0.37
LMNA P02545 4/20 0.36
ALDH1A1 P00352 3/20 0.36
RAB9A P51151 2/20 0.36
GRIA2 P42262 1/20 0.36
GRIA4 P48058 1/20 0.36
MEN1 O00255 4/20 0.36
KMT2A Q03164 4/20 0.36
ATM Q13315 2/20 0.36
KDM4E B2RXH2 3/20 0.34
HPGD P15428 3/20 0.34
MAPT P10636 2/20 0.34
POLB P06746 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
TSHR P16473 2/20 0.33
MAPK8 P45983 1/20 0.33
NPC1 O15118 1/20 0.33
GAA P10253 1/20 0.33

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
SCHEMBL15162445 1.00 AR (0.43) ARAKT1LOXL2LMNAALDH1A1
SCHEMBL1126610 0.84 TSHR (0.47) ARLMNAALDH1A1RAB9AMEN1
SCHEMBL1126609 0.84 TSHR (0.47) ARLMNAALDH1A1RAB9AMEN1
SCHEMBL1127384 0.80 AR (0.46) ARLMNAALDH1A1RAB9AGRIA2
SCHEMBL1126728 0.78 AR (0.44) ARALDH1A1GRIA2GRIA4MEN1
SCHEMBL1988958 0.77 KDM4E (0.49) ARLMNAALDH1A1RAB9AGRIA2
SCHEMBL1127194 0.77 AR (0.43) ARLMNAALDH1A1RAB9AGRIA2
SCHEMBL1127427 0.75 KDM4E (0.45) ARLMNAALDH1A1GRIA2GRIA4
SCHEMBL1126865 0.75 AR (0.44) ARLMNAALDH1A1RAB9AGRIA2
SCHEMBL1126637 0.75 AR (0.60) ARLMNAALDH1A1MEN1KMT2A

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
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
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 (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-20150238500-A1 PYRROLE ANTIFUNGAL AGENTS FOXM1, PYCR1, ARG1 AR 2125/4885AKT1 1823/4885LOXL2 4247/4885

“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.