SCHEMBL21547039

SCHEMBL21547039

Cc1cccc(-c2ccc3c(c2)c2ccccc2n3-c2cc(C(F)(F)F)cc(-n3c4ccccc4c4cc(-c5cccc(C)c5)ccc43)c2-c2cccc(C#N)c2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.41
PTPN5 P54829 1/20 0.39
MAT2A P31153 2/20 0.39
ALDH1A1 P00352 2/20 0.36
CYP1A2 P05177 2/20 0.36
KDM4E B2RXH2 1/20 0.36
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.36
CYP2C9 P11712 1/20 0.36
HPGD P15428 1/20 0.36
TSHR P16473 1/20 0.36
MAPK1 P28482 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HSD17B10 Q99714 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
SYK P43405 1/20 0.36
PTGER4 P35408 1/20 0.36
ICMT O60725 1/20 0.35
PDK2 Q15119 1/20 0.35
GRM5 P41594 1/20 0.34

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
SCHEMBL22761031 0.96 AR (0.44) ARPTPN5MAT2AALDH1A1CYP1A2
SCHEMBL22760883 0.95 AR (0.41) ARPTPN5MAT2AALDH1A1CYP1A2
SCHEMBL21547037 0.94 PTPN5 (0.42) ARPTPN5MAT2ASYKPTGER4
SCHEMBL21547130 0.94 PTPN5 (0.44) PTPN5MAT2AALDH1A1CYP1A2SYK
SCHEMBL20617163 0.93 AR (0.41) ARPTPN5MAT2AALDH1A1CYP1A2
SCHEMBL22760735 0.93 MAT2A (0.41) ARPTPN5MAT2AALDH1A1CYP1A2
SCHEMBL21547088 0.92 PTPN5 (0.45) PTPN5MAT2AALDH1A1CYP1A2LMNA
SCHEMBL19912512 0.91 MAT2A (0.39) ARPTPN5MAT2AALDH1A1CYP1A2
SCHEMBL19917966 0.91 AR (0.41) ARPTPN5MAT2APTGER4ICMT
SCHEMBL21546775 0.91 SYK (0.42) ARPTPN5MAT2AALDH1A1CYP1A2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10981930-B2 Organic molecules for use in optoelectronic devices CYNORA GMBH (DE) 2021-04-20 US disclosed
US-20200385399-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2020-12-10 US disclosed
EP-3478793-B1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2019-11-06 EP 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-10981930-B2 Organic molecules for use in optoelectronic devices OR10J3, OR51E2, EPCAM AR 4523/4885PTPN5 4550/4885MAT2A 1149/4885
US-20200385399-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OR10J3, OR51E2, EPCAM AR 4523/4885PTPN5 4550/4885MAT2A 1149/4885

“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.