SCHEMBL23219543

SCHEMBL23219543

N#Cc1ccc2c(c1)c1cc(C#N)ccc1n2-c1cccc(C#N)c1-c1c(-c2c(C(F)(F)F)cccc2C(F)(F)F)cccc1-n1c2ccc(C#N)cc2c2cc(C#N)ccc21

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AR P10275 7/20 0.36
ACP1 P24666 1/20 0.34
GABRA1 P14867 2/20 0.33
GABRG2 P18507 2/20 0.33
GABRB3 P28472 2/20 0.33
GABRA5 P31644 2/20 0.33
GABRA3 P34903 2/20 0.33
PDK2 Q15119 1/20 0.33
PGR P06401 1/20 0.32
CRHR1 P34998 2/20 0.32
PTGES O14684 1/20 0.32
SLC22A12 Q96S37 1/20 0.32
TRPV4 Q9HBA0 1/20 0.32
TRPA1 O75762 1/20 0.31
C5AR1 P21730 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
SCHEMBL20849485 0.96 AR (0.36) ARACP1GABRA1GABRG2GABRB3
SCHEMBL20848615 0.91 AR (0.38) ARACP1GABRA1GABRG2GABRB3
SCHEMBL22985731 0.90 AR (0.34) ARGABRA1GABRG2GABRB3GABRA5
SCHEMBL20849486 0.89 PSEN1 (0.31) AR
SCHEMBL20849654 0.88 AR (0.38) ARACP1GABRA1GABRG2GABRB3
SCHEMBL20849478 0.88 AR (0.39) ARPDK2PGR
SCHEMBL20849470 0.88 AR (0.39) ARACP1GABRA1GABRG2GABRB3
SCHEMBL20848614 0.87 AR (0.45) ARGABRA1GABRG2GABRB3GABRA5
SCHEMBL20849357 0.87 AR (0.35) ARPDK2PGR
SCHEMBL22985733 0.86 AR (0.33) ARACP1GABRA1GABRG2GABRB3

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-10978646-B2 Organic molecules for use in optoelectronic devices CYNORA GMBH (DE) 2021-04-13 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-10978646-B2 Organic molecules for use in optoelectronic devices OCIAD2, OCIAD1, POU2F1 AR 3706/4885ACP1 2186/4885GABRA1 4500/4885

“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.