SCHEMBL22985013

SCHEMBL22985013

Cc1ccccc1-c1ccc2c(c1)c1ccccc1n2-c1cccc(C#N)c1-c1c(-c2ccc(C#N)cc2C(F)(F)F)cccc1-n1c2ccccc2c2cc(-c3ccccc3C)ccc21

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
AR P10275 14/20 0.46
PGR P06401 2/20 0.34
PDE3B Q13370 1/20 0.33
PDE3A Q14432 1/20 0.33
PTGER4 P35408 1/20 0.32
ELANE P08246 1/20 0.31
GABRA1 P14867 1/20 0.31
GABRG2 P18507 1/20 0.31
GABRB3 P28472 1/20 0.31
GABRA5 P31644 1/20 0.31
GABRA3 P34903 1/20 0.31
RORC P51449 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
SCHEMBL22985534 0.94 AR (0.40) ARPGRPDE3BPDE3APTGER4
SCHEMBL22985102 0.93 AR (0.37) ARPGRPDE3BPDE3AGABRA1
SCHEMBL22985144 0.92 AR (0.37) ARPGRPDE3BPDE3APTGER4
SCHEMBL22985147 0.92 AR (0.36) ARPGRPDE3BPDE3AGABRA1
SCHEMBL22985126 0.92 AR (0.45) ARPGRPDE3BPDE3APTGER4
SCHEMBL22985635 0.92 AR (0.40) ARPGRPDE3BPDE3APTGER4
SCHEMBL20848864 0.92 AR (0.46) ARPGRPDE3BPDE3ARORC
SCHEMBL22985149 0.91 KIF11 (0.36) ARPGRPDE3BPDE3APTGER4
SCHEMBL22985146 0.91 AR (0.37) ARPGRPDE3BPDE3APTGER4
SCHEMBL22985014 0.91 AR (0.44) ARPGRPDE3BPDE3APTGER4

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 3541/4885PGR 3779/4885PDE3B 3219/4885

“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.