SCHEMBL20848827

SCHEMBL20848827

Cc1nc(C)nc(-c2ccc3c(c2)c2ccccc2n3-c2ccc(C#N)c(-c3cc(-c4ccc(C(F)(F)F)cc4C(F)(F)F)ccc3-n3c4ccccc4c4cc(-c5nc(C)nc(C)n5)ccc43)c2)n1

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AR P10275 12/20 0.34
SCN9A Q15858 3/20 0.33
CYP2C9 P11712 1/20 0.33
PGR P06401 2/20 0.31
PSEN1 P49768 1/20 0.31
PSEN2 P49810 1/20 0.31
APH1B Q8WW43 1/20 0.31
NCSTN Q92542 1/20 0.31
APH1A Q96BI3 1/20 0.31
PSENEN Q9NZ42 1/20 0.31
ABCG2 Q9UNQ0 1/20 0.31
NR3C1 P04150 1/20 0.30
XDH P47989 1/20 0.30
RORC P51449 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
SCHEMBL20848825 0.96 CYP2C9 (0.33) ARSCN9ACYP2C9PSEN1PSEN2
SCHEMBL22985722 0.94 ALOX5AP (0.35) ARPSEN1PSEN2APH1BNCSTN
SCHEMBL22985430 0.92 PTGER4 (0.34) ARPGRABCG2NR3C1RORC
SCHEMBL22243213 0.92 AR (0.35) ARSCN9ACYP2C9PGRABCG2
SCHEMBL20849560 0.92 AR (0.35) ARSCN9ACYP2C9PGRABCG2
SCHEMBL20848849 0.91 AR (0.40) ARSCN9ACYP2C9PGRRORC
SCHEMBL20848826 0.90 AR (0.36) ARSCN9ACYP2C9PGRABCG2
SCHEMBL22985725 0.90 ALOX5AP (0.38) ARPSEN1PSEN2APH1BNCSTN
SCHEMBL20848699 0.90 AR (0.40) ARSCN9ACYP2C9PGRRORC
SCHEMBL20848883 0.90 AR (0.40) ARSCN9APGRRORC

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-10978646-B2 Organic molecules for use in optoelectronic devices CYNORA GMBH (DE) 2021-04-13 US disclosed
US-20190097141-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2019-03-28 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-10978646-B2 Organic molecules for use in optoelectronic devices OCIAD2, OCIAD1, POU2F1 AR 3706/4885SCN9A 1664/4885CYP2C9 725/4885
US-20190097141-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OCIAD2, OCIAD1, POU2F1 AR 3706/4885SCN9A 1664/4885CYP2C9 725/4885

“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.