SCHEMBL20849286

SCHEMBL20849286

CC(C)(C)c1ccc2c(c1)c1ccccc1n2-c1ccc(C#N)cc1-c1ccc(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1-n1c2ccccc2c2cc(C(C)(C)C)ccc21

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 3/20 0.34
TACR1 P25103 2/20 0.33
ICMT O60725 2/20 0.33
RORC P51449 3/20 0.33
PTGER4 P35408 1/20 0.33
RXRA P19793 1/20 0.32
RXRG P48443 1/20 0.32
PTPN5 P54829 1/20 0.31
CETP P11597 1/20 0.31
PDK2 Q15119 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
SCHEMBL20849561 0.96 KIF11 (0.35) KIF11TACR1ICMTRORCPTGER4
SCHEMBL20848843 0.95 RORC (0.36) KIF11TACR1ICMTRORCPTGER4
SCHEMBL20849249 0.95 KIF11 (0.36) KIF11TACR1ICMTRXRARXRG
SCHEMBL20848771 0.93 RXRA (0.35) KIF11TACR1ICMTPTGER4RXRA
SCHEMBL20849579 0.93 RXRA (0.35) KIF11TACR1ICMTRORCPTGER4
SCHEMBL20848858 0.91 KIF11 (0.36) KIF11TACR1RORCRXRARXRG
SCHEMBL21399771 0.91 KIF11 (0.36) KIF11TACR1ICMTPTGER4RXRA
SCHEMBL20848855 0.91 KIF11 (0.39) KIF11TACR1ICMTRORCPTGER4
SCHEMBL20848929 0.91 KIF11 (0.37) KIF11TACR1ICMTRORCPTGER4
SCHEMBL20848534 0.91 KIF11 (0.37) KIF11TACR1ICMTRXRARXRG

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 KIF11 419/4885TACR1 2846/4885ICMT 616/4885
US-20190097141-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OCIAD2, OCIAD1, POU2F1 KIF11 419/4885TACR1 2846/4885ICMT 616/4885

“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.