SCHEMBL20848844

SCHEMBL20848844

CC(C)(C)c1ccc2c(c1)c1cc(C(C)(C)C)ccc1n2-c1ccc(C#N)cc1-c1cc(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)ccc1-n1c2ccc(C(C)(C)C)cc2c2cc(C(C)(C)C)ccc21

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 3/20 0.40
ICMT O60725 1/20 0.37
RXRA P19793 1/20 0.37
RXRG P48443 1/20 0.37
RAPGEF3 O95398 1/20 0.34
RAPGEF4 Q8WZA2 1/20 0.34
TACR1 P25103 1/20 0.33
DDR1 Q08345 1/20 0.33
CSNK1D P48730 2/20 0.33
CSNK1G2 P78368 2/20 0.33
PTGDR2 Q9Y5Y4 2/20 0.32
CYP11B2 P19099 1/20 0.32
CASP3 P42574 1/20 0.32
FNTA P49354 1/20 0.32
FNTB P49356 1/20 0.32
PGGT1B P53609 1/20 0.32
TMPRSS4 Q9NRS4 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
SCHEMBL20848843 0.95 RORC (0.36) KIF11ICMTRXRARXRGTACR1
SCHEMBL20848534 0.95 KIF11 (0.37) KIF11ICMTRXRARXRGRAPGEF3
SCHEMBL20848920 0.94 KIF11 (0.42) KIF11ICMTRXRARXRGTACR1
SCHEMBL20848916 0.92 KIF11 (0.41) KIF11ICMTRXRARXRGTACR1
SCHEMBL20849275 0.92 KIF11 (0.41) KIF11ICMTRXRARXRGTACR1
SCHEMBL20849565 0.90 KIF11 (0.39) KIF11ICMTRXRARXRGRAPGEF3
SCHEMBL20849286 0.90 KIF11 (0.34) KIF11ICMTRXRARXRGTACR1
SCHEMBL20848570 0.90 KIF11 (0.46) KIF11RXRARXRGTACR1PTGDR2
SCHEMBL20848913 0.89 KIF11 (0.38) KIF11ICMTRXRARXRGTACR1
SCHEMBL20848842 0.89 RXRA (0.37) KIF11ICMTRXRARXRGTACR1

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 419/4885ICMT 616/4885RXRA 1822/4885
US-20190097141-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OCIAD2, OCIAD1, POU2F1 KIF11 419/4885ICMT 616/4885RXRA 1822/4885

“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.