SCHEMBL19259022

SCHEMBL19259022

CCCCc1cc(CCCC)cc(C(=O)OC)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4A11 Q02928 4/20 0.51
CYP4F2 P78329 3/20 0.51
GPR84 Q9NQS5 2/20 0.49
MDH1 P40925 2/20 0.47
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA7 P43166 1/20 0.47
CA9 Q16790 1/20 0.47
CA14 Q9ULX7 1/20 0.47
PLK1 P53350 1/20 0.46
KDM4E B2RXH2 3/20 0.46
LMNA P02545 2/20 0.46
POLB P06746 1/20 0.46
GAA P10253 1/20 0.46
NFKB1 P19838 1/20 0.46
XDH P47989 1/20 0.46
GFER P55789 1/20 0.46
NFKB2 Q00653 1/20 0.46
RELA Q04206 1/20 0.46

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
SCHEMBL16247137 0.96 CYP4A11 (0.51) CYP4A11CYP4F2GPR84MDH1CA12
SCHEMBL16950976 0.93 PRKCA (0.51) CYP4A11CYP4F2GPR84MDH1CA12
SCHEMBL25340179 0.93 GPR84 (0.54) CYP4A11CYP4F2GPR84MDH1
SCHEMBL16955938 0.90 CYP4A11 (0.47) CYP4A11CYP4F2GPR84MDH1CA12
SCHEMBL15963129 0.89 CYP4A11 (0.53) CYP4A11CYP4F2GPR84MDH1
SCHEMBL16950973 0.86 CYP4A11 (0.43) CYP4A11CYP4F2GPR84MDH1CA12
SCHEMBL16956798 0.85 MDH1 (0.43) CYP4A11CYP4F2GPR84MDH1CA12
SCHEMBL16956800 0.85 THRB (0.43) CYP4A11CYP4F2MDH1CA12CA1
SCHEMBL17367304 0.84 CYP4A11 (0.48) CYP4A11CYP4F2GPR84MDH1
SCHEMBL7110194 0.84 CYP4A11 (0.48) CYP4A11CYP4F2GPR84MDH1CA1

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-9793499-B2 Organic iridium complex for organic electroluminescent element TANAKA KIKINZOKU KOGYO K.K. (JP) 2017-10-17 US disclosed
US-20170237021-A1 ORGANIC IRIDIUM COMPLEX FOR ORGANIC ELECTROLUMINESCENT ELEMENTS TANAKA KIKINZOKU KOGYO K.K. (JP) 2017-08-17 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 (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-20170237021-A1 ORGANIC IRIDIUM COMPLEX FOR ORGANIC ELECTROLUMINESCENT ELEMENTS L1CAM, ETFA, TTI2 CYP4A11 4292/4885CYP4F2 2127/4885GPR84 3487/4885

“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.