SCHEMBL20848741

SCHEMBL20848741

Cc1cccc(-c2ccc3c(c2)c2ccccc2n3-c2ccc(C#N)cc2-c2cc(-c3ccc(C(F)(F)F)cc3C(F)(F)F)ccc2-n2c3ccccc3c3cc(-c4cccc(C)c4)ccc32)c1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
AR P10275 3/20 0.41
CYP2C9 P11712 1/20 0.36
SCN9A Q15858 1/20 0.36
PTGER4 P35408 1/20 0.34
ICMT O60725 1/20 0.34
EDNRB P24530 1/20 0.33
EDNRA P25101 1/20 0.33
PTGDR2 Q9Y5Y4 1/20 0.33
ELANE P08246 5/20 0.33
PTPN5 P54829 1/20 0.33
KIF11 P52732 1/20 0.32
HCRTR1 O43613 1/20 0.32
HCRTR2 O43614 1/20 0.32
ENPP1 P22413 1/20 0.32
MAT2A P31153 1/20 0.32
PDK2 Q15119 1/20 0.32

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
SCHEMBL20848481 0.97 AR (0.39) ARCYP2C9SCN9APTGER4ICMT
SCHEMBL20849524 0.97 AR (0.39) ARCYP2C9SCN9APTGER4ICMT
SCHEMBL20848742 0.96 AR (0.43) ARCYP2C9SCN9AICMTEDNRB
SCHEMBL22985413 0.95 AR (0.43) ARCYP2C9PTGER4ELANEPTPN5
SCHEMBL20848746 0.94 PTGER4 (0.33) ARCYP2C9SCN9APTGER4EDNRB
SCHEMBL20848430 0.93 AR (0.41) ARCYP2C9SCN9APTGER4ICMT
SCHEMBL20848480 0.93 AR (0.42) ARCYP2C9SCN9AICMTEDNRB
SCHEMBL20848475 0.93 AR (0.42) ARCYP2C9SCN9AICMTPTGDR2
SCHEMBL20848743 0.93 AR (0.37) ARCYP2C9SCN9APTGER4ICMT
SCHEMBL20848795 0.93 PTPN5 (0.39) ARCYP2C9SCN9AEDNRBEDNRA

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 3706/4885CYP2C9 725/4885SCN9A 1664/4885
US-20190097141-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OCIAD2, OCIAD1, POU2F1 AR 3706/4885CYP2C9 725/4885SCN9A 1664/4885

“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.