SCHEMBL20156180

SCHEMBL20156180

Cc1nc(C)nc(-c2ccc(-n3c4cc(-c5ccc(C(F)(F)F)cc5C(F)(F)F)ccc4c4ccc(-c5ccc(C(F)(F)F)cc5C(F)(F)F)cc43)cc2C#N)n1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 2/20 0.37
FEN1 P39748 2/20 0.37
XDH P47989 2/20 0.35
SCN9A Q15858 2/20 0.35
CYP2C9 P11712 1/20 0.35
AR P10275 7/20 0.34
PDE2A O00408 1/20 0.31
HSD17B1 P14061 1/20 0.31
HSD17B2 P37059 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
HPGD P15428 1/20 0.31
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
PGR P06401 1/20 0.31

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
SCHEMBL20156179 0.94 AR (0.36) ALOX5APFEN1XDHSCN9ACYP2C9
SCHEMBL20156225 0.90 MAT2A (0.36) ALOX5APFEN1XDHSCN9AAR
SCHEMBL21108056 0.90 ALOX5AP (0.37) ALOX5APFEN1XDHSCN9ACYP2C9
SCHEMBL20114889 0.87 XDH (0.35) ALOX5APFEN1XDHARALDH1A1
SCHEMBL21108049 0.87 ALOX5AP (0.35) ALOX5APFEN1XDHSCN9ACYP2C9
SCHEMBL20114995 0.87 AR (0.36) ALOX5APFEN1XDHSCN9ACYP2C9
SCHEMBL20114890 0.85 AR (0.36) ALOX5APFEN1XDHSCN9ACYP2C9
SCHEMBL20150425 0.85 KIF11 (0.42) ALOX5APFEN1XDHSCN9AAR
SCHEMBL21109632 0.84 ALOX5AP (0.35) ALOX5APFEN1XDHSCN9ACYP2C9
SCHEMBL20111580 0.84 XDH (0.36) ALOX5APFEN1XDHSCN9ACYP2C9

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-10421746-B2 Organic molecules, especially for use in organic optoelectronic devices CYNORA GMBH (DE) 2019-09-24 US disclosed
US-20180134686-A1 ORGANIC MOLECULES, ESPECIALLY FOR USE IN ORGANIC OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2018-05-17 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 (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-20180134686-A1 ORGANIC MOLECULES, ESPECIALLY FOR USE IN ORGANIC OPTOELECTRONIC DEVICES OR10J3, EPCAM, F12 ALOX5AP 4191/4885FEN1 2120/4885XDH 122/4885
US-10421746-B2 Organic molecules, especially for use in organic optoelectronic devices OR10J3, EPCAM, F12 ALOX5AP 4191/4885FEN1 2120/4885XDH 122/4885

“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.