SCHEMBL22985322

SCHEMBL22985322

Cc1ccc(-c2ccc3c(c2)c2cc(-c4ccc(C)cc4C)ccc2n3-c2ccc(C#N)cc2-c2ccc(-c3ccc(C#N)cc3C(F)(F)F)cc2-n2c3ccc(-c4ccc(C)cc4C)cc3c3cc(-c4ccc(C)cc4C)ccc32)c(C)c1

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
AR P10275 8/20 0.35
NSD2 O96028 1/20 0.32
AKR1C3 P42330 1/20 0.32
AKR1C2 P52895 1/20 0.32
KIF11 P52732 1/20 0.32
CYP11B1 P15538 1/20 0.31
CYP11B2 P19099 1/20 0.31
ELANE P08246 1/20 0.31
TRPV4 Q9HBA0 1/20 0.31
XDH P47989 1/20 0.30
SLC22A12 Q96S37 1/20 0.30
EGLN2 Q96KS0 1/20 0.30

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
SCHEMBL22985091 0.96 AR (0.35) ARNSD2AKR1C3AKR1C2KIF11
SCHEMBL22985401 0.96 AR (0.37) ARNSD2AKR1C3AKR1C2KIF11
SCHEMBL22985010 0.96 AR (0.37) ARNSD2AKR1C3AKR1C2KIF11
SCHEMBL22985385 0.95 AR (0.37) ARNSD2ELANE
SCHEMBL20848922 0.94 AR (0.33) ARNSD2AKR1C3AKR1C2KIF11
SCHEMBL22985560 0.94 AR (0.36) ARNSD2AKR1C3AKR1C2KIF11
SCHEMBL22985327 0.92 AR (0.33) ARNSD2KIF11CYP11B1CYP11B2
SCHEMBL22985333 0.92 AR (0.42) ARNSD2AKR1C3AKR1C2KIF11
SCHEMBL22985090 0.92 AR (0.37) ARNSD2ELANE
SCHEMBL22985002 0.92 AR (0.38) ARNSD2AKR1C3AKR1C2KIF11

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 3541/4885NSD2 756/4885AKR1C3 3194/4885

“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.