SCHEMBL20849643

SCHEMBL20849643

CC(C)(C)c1ccc2c(c1)c1ccccc1n2-c1ccc(C#N)cc1-c1cc(-c2c(C(F)(F)F)cccc2C(F)(F)F)ccc1-n1c2ccccc2c2cc(C(C)(C)C)ccc21

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
RORC P51449 3/20 0.36
KIF11 P52732 4/20 0.35
PTGER4 P35408 1/20 0.34
AR P10275 5/20 0.33
ACP1 P24666 1/20 0.33
SLC22A12 Q96S37 3/20 0.33
PTPN5 P54829 1/20 0.32
PTGES O14684 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
SCHEMBL20849644 0.96 KIF11 (0.38) KIF11ARSLC22A12PTPN5
SCHEMBL20849188 0.95 KIF11 (0.33) RORCKIF11PTGER4ARACP1
SCHEMBL20848554 0.95 RORC (0.34) RORCKIF11PTGER4ARACP1
SCHEMBL20848562 0.94 KIF11 (0.36) RORCKIF11ARACP1SLC22A12
SCHEMBL21399519 0.92 RORC (0.34) RORCKIF11ARACP1SLC22A12
SCHEMBL20848561 0.92 AR (0.36) RORCKIF11PTGER4ARACP1
SCHEMBL20848887 0.91 KIF11 (0.34) RORCKIF11PTGER4ARACP1
SCHEMBL20848545 0.91 KIF11 (0.36) KIF11ARSLC22A12PTPN5
SCHEMBL22985687 0.90 RORC (0.36) RORCKIF11PTGER4AR
SCHEMBL20848551 0.90 KIF11 (0.40) KIF11ARPTPN5

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 RORC 379/4885KIF11 419/4885PTGER4 3716/4885
US-20190097141-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OCIAD2, OCIAD1, POU2F1 RORC 379/4885KIF11 419/4885PTGER4 3716/4885

“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.