SCHEMBL22984987

SCHEMBL22984987

Cc1ccc(-c2ccc3c(c2)c2cc(-c4ccc(C)cc4C)ccc2n3-c2cccc(C#N)c2-c2c(-c3ccc(C(F)(F)F)cc3C#N)cccc2-n2c3ccc(-c4ccc(C)cc4C)cc3c3cc(-c4ccc(C)cc4C)ccc32)c(C)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 5/20 0.37
ALOX5AP P20292 1/20 0.35
FEN1 P39748 1/20 0.35
XDH P47989 2/20 0.34
TSHR P16473 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
GCGR P47871 1/20 0.31
BCAT1 P54687 1/20 0.31
HTR6 P50406 2/20 0.30
HRH1 P35367 1/20 0.30
SCN9A Q15858 1/20 0.30
GABRA1 P14867 1/20 0.30
GABRG2 P18507 1/20 0.30
GABRB3 P28472 1/20 0.30
GABRA5 P31644 1/20 0.30
GABRA3 P34903 1/20 0.30
GABRA2 P47869 1/20 0.30
HCRTR1 O43613 1/20 0.30
HCRTR2 O43614 1/20 0.30
NR3C1 P04150 1/20 0.30

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
SCHEMBL22985424 0.97 AR (0.37) ARALOX5APFEN1XDHTSHR
SCHEMBL20849011 0.93 AR (0.40) ARALOX5APFEN1XDHTSHR
SCHEMBL22985649 0.93 AR (0.45) ARALOX5APFEN1XDHTSHR
SCHEMBL22984988 0.93 ALOX5AP (0.34) ARALOX5APFEN1XDHTSHR
SCHEMBL22985179 0.92 AR (0.39) ARALOX5APFEN1XDHTSHR
SCHEMBL22985180 0.92 HTR6 (0.35) ARALOX5APFEN1XDHTSHR
SCHEMBL22985183 0.91 AR (0.43) ARALOX5APFEN1XDHTSHR
SCHEMBL22985667 0.90 ALOX5AP (0.36) ARALOX5APFEN1XDHTSHR
SCHEMBL22985643 0.90 AR (0.43) ARALOX5APFEN1XDHTSHR
SCHEMBL20848573 0.90 AR (0.38) ARXDHGABRA1GABRG2GABRB3

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10919880-B2 Organic molecules, in particular for use in optoelectronic devices CYNORA GMBH (DE) 2021-02-16 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-10919880-B2 Organic molecules, in particular for use in optoelectronic devices OCIAD1, OCIAD2, POU2F1 AR 3541/4885ALOX5AP 2567/4885FEN1 2939/4885

“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.