SCHEMBL22985608

SCHEMBL22985608

N#Cc1ccc(-n2c3ccccc3c3cc(C#N)ccc32)c(-c2cc(-c3ccc(C#N)cc3C(F)(F)F)ccc2-n2c3ccccc3c3cc(C#N)ccc32)c1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
AR P10275 9/20 0.39
KIF11 P52732 1/20 0.35
PGR P06401 2/20 0.34
TRPV4 Q9HBA0 1/20 0.34
XDH P47989 1/20 0.33
SLC22A12 Q96S37 1/20 0.33
PTGER4 P35408 1/20 0.33
NSD2 O96028 1/20 0.33
RORC P51449 1/20 0.33
PDK2 Q15119 2/20 0.33
TRPA1 O75762 1/20 0.33
PDPK1 O15530 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
SCHEMBL22985592 0.96 AR (0.38) ARKIF11PGRTRPV4PTGER4
SCHEMBL22985060 0.96 AR (0.38) ARKIF11PGRTRPV4XDH
SCHEMBL22985410 0.95 KIF11 (0.41) ARKIF11PGRTRPV4PTGER4
SCHEMBL22985609 0.94 KIF11 (0.39) ARKIF11PGRTRPV4XDH
SCHEMBL22985610 0.94 KIF11 (0.36) ARKIF11PGRRORC
SCHEMBL22985612 0.94 AR (0.36) ARKIF11PGRTRPV4PDPK1
SCHEMBL20848837 0.94 KIF11 (0.36) ARKIF11PGRXDHSLC22A12
SCHEMBL22984999 0.94 KIF11 (0.38) ARKIF11PGRTRPV4PTGER4
SCHEMBL22985596 0.94 AR (0.36) ARKIF11PGRTRPV4PDPK1
SCHEMBL24370162 0.93 AR (0.36) ARKIF11PGRTRPV4PTGER4

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 3541/4885KIF11 525/4885PGR 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.