SCHEMBL20849641

SCHEMBL20849641

Cc1ccccc1-c1ccc2c(c1)c1ccccc1n2-c1ccc(C#N)cc1-c1cc(-c2c(C(F)(F)F)cccc2C(F)(F)F)ccc1-n1c2ccccc2c2cc(-c3ccccc3C)ccc21

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
AR P10275 8/20 0.46
PTGER4 P35408 1/20 0.35
ACP1 P24666 1/20 0.34
TRPA1 O75762 3/20 0.33
PGR P06401 2/20 0.33
ELANE P08246 2/20 0.32
RORC P51449 2/20 0.32
ENPP1 P22413 1/20 0.31
KIF11 P52732 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
SCHEMBL20849645 0.97 AR (0.48) ARACP1TRPA1PGRELANE
SCHEMBL20849236 0.95 AR (0.43) ARPTGER4ACP1TRPA1PGR
SCHEMBL20849125 0.95 AR (0.43) ARPTGER4ACP1TRPA1PGR
SCHEMBL21399468 0.94 AR (0.44) ARPTGER4ACP1TRPA1PGR
SCHEMBL20849237 0.93 AR (0.46) ARACP1TRPA1PGRELANE
SCHEMBL20849135 0.93 AR (0.46) ARACP1TRPA1PGRELANE
SCHEMBL20849615 0.92 AR (0.37) ARPTGER4ACP1TRPA1ELANE
SCHEMBL20849182 0.92 AR (0.45) ARPTGER4ACP1TRPA1PGR
SCHEMBL21399741 0.92 AR (0.45) ARPTGER4ACP1TRPA1PGR
SCHEMBL22985418 0.91 AR (0.47) ARPTGER4TRPA1PGRELANE

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 3706/4885PTGER4 3716/4885ACP1 2186/4885
US-20190097141-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OCIAD2, OCIAD1, POU2F1 AR 3706/4885PTGER4 3716/4885ACP1 2186/4885

“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.