SCHEMBL22985679

SCHEMBL22985679

Cc1ccccc1-c1ccc2c(c1)c1cc(-c3ccccc3C)ccc1n2-c1ccc(-c2ccc(C#N)cc2C(F)(F)F)cc1-c1ccc(C#N)cc1-n1c2ccc(-c3ccccc3C)cc2c2cc(-c3ccccc3C)ccc21

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
AR P10275 9/20 0.47
TRPA1 O75762 2/20 0.34
PGR P06401 2/20 0.34
PDK2 Q15119 3/20 0.33
ELANE P08246 1/20 0.33
NSD2 O96028 1/20 0.32
KIF11 P52732 1/20 0.32
S1PR1 P21453 2/20 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
SCHEMBL22985677 0.97 AR (0.45) ARTRPA1PGRPDK2ELANE
SCHEMBL22985371 0.96 AR (0.47) ARTRPA1PGRPDK2ELANE
SCHEMBL22985419 0.96 AR (0.49) ARTRPA1PGRPDK2ELANE
SCHEMBL22985567 0.96 AR (0.49) ARTRPA1PGRPDK2ELANE
SCHEMBL20848442 0.94 AR (0.44) ARTRPA1PGRPDK2ELANE
SCHEMBL22985377 0.93 AR (0.45) ARTRPA1PGRPDK2ELANE
SCHEMBL22985565 0.93 AR (0.47) ARTRPA1PGRPDK2ELANE
SCHEMBL22985418 0.93 AR (0.47) ARTRPA1PGRPDK2ELANE
SCHEMBL20849237 0.92 AR (0.46) ARTRPA1PGRPDK2ELANE
SCHEMBL20848445 0.92 AR (0.42) ARTRPA1PGRELANEKIF11

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10919880-B2 Organic molecules, in particular for use in optoelectronic devices CYNORA GMBH (DE) 2021-02-16 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 (1 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-10919880-B2 Organic molecules, in particular for use in optoelectronic devices OCIAD1, OCIAD2, POU2F1 AR 3541/4885TRPA1 91/4885PGR 3779/4885

“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.