SCHEMBL20848593

SCHEMBL20848593

N#Cc1ccc(-n2c3ccc(C#N)cc3c3cc(C#N)ccc32)c(-c2cc(-n3c4ccc(C#N)cc4c4cc(C#N)ccc43)ccc2-c2c(C(F)(F)F)cccc2C(F)(F)F)c1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ACP1 P24666 1/20 0.31
SLC22A12 Q96S37 1/20 0.31
ELANE P08246 2/20 0.31
TRPV4 Q9HBA0 1/20 0.31
AR P10275 5/20 0.31
KDM1A O60341 1/20 0.31
PDK2 Q15119 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
SCHEMBL20848592 0.96 ACP1 (0.33) ACP1SLC22A12ARPDK2
SCHEMBL20849494 0.94 ACP1 (0.33) ACP1SLC22A12ARPDK2
SCHEMBL20849489 0.94 ACP1 (0.33) ACP1SLC22A12ARPDK2
SCHEMBL20849393 0.94 ELANE (0.35) ELANE
SCHEMBL20849658 0.93 KIF11 (0.39) ARPDK2
SCHEMBL20849418 0.92 ELANE (0.32) SLC22A12ELANETRPV4AR
SCHEMBL20849492 0.91 KIF11 (0.35) ACP1ARPDK2
SCHEMBL20849443 0.91 PGR (0.33) ARPDK2
SCHEMBL20849257 0.90 AR (0.35) AR
SCHEMBL20849392 0.90 ELANE (0.33) ACP1ELANEAR

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 2 patents. 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
US-20190097141-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2019-03-28 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 (2 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 ACP1 2186/4885SLC22A12 1191/4885ELANE 4164/4885
US-20190097141-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OCIAD2, OCIAD1, POU2F1 ACP1 2186/4885SLC22A12 1191/4885ELANE 4164/4885

“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.