SCHEMBL19908987

SCHEMBL19908987

N#Cc1c(F)ccc(-c2ccncc2)c1F

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SQOR Q9Y6N5 2/20 0.43
ADORA1 P30542 2/20 0.38
ADORA2A P29274 1/20 0.38
MAPK14 Q16539 3/20 0.38
GCGR P47871 2/20 0.38
LRRK2 Q5S007 1/20 0.37
KDM4E B2RXH2 3/20 0.36
LMNA P02545 2/20 0.36
CYP2C19 P33261 2/20 0.36
ALDH1A1 P00352 2/20 0.36
PDE5A O76074 1/20 0.36
HPGD P15428 1/20 0.36
TSHR P16473 1/20 0.36
PTGS1 P23219 1/20 0.36
PDE4A P27815 1/20 0.36
BLM P54132 1/20 0.36
PDE4B Q07343 1/20 0.36
PDE4C Q08493 1/20 0.36
PDE4D Q08499 1/20 0.36
PDE3B Q13370 1/20 0.36

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
SCHEMBL6989208 0.81 ADORA1 (0.43) SQORADORA1ADORA2AKDM4ECYP2C19
SCHEMBL27968505 0.81 ALDH1A1 (0.33) SQORADORA1ADORA2AKDM4EALDH1A1
SCHEMBL19737771 0.79 PTGS2 (0.42) ADORA1ADORA2AKDM4EALDH1A1HPGD
SCHEMBL12679770 0.78 SQOR (0.46) SQORADORA1ADORA2AKDM4ELMNA
SCHEMBL27831776 0.77 MAPT (0.43) MAPK14GCGRLMNAPDE3BPDE3A
SCHEMBL27988588 0.75 CLK4 (0.36) SQORADORA1ADORA2ALRRK2KDM4E
SCHEMBL21677421 0.72 KDM4E (0.42) SQORADORA1ADORA2AMAPK14KDM4E
SCHEMBL19909038 0.72 TRPV4 (0.47) SQORADORA1ADORA2AMAPK14GCGR
SCHEMBL20740893 0.72 KDM4E (0.42) SQORADORA1ADORA2AMAPK14GCGR
SCHEMBL21397221 0.71 ADORA1 (0.32) ADORA1ADORA2ALMNAALDH1A1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11588114-B2 Organic molecules for use in optoelectronic devices SAMSUNG DISPLAY CO., LTD. (KR) 2023-02-21 US disclosed
US-20200212316-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2020-07-02 US disclosed
US-10665792-B2 Organic molecules for use in optoelectronic devices CYNORA GMBH (DE) 2020-05-26 US disclosed
US-20180062085-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2018-03-01 US disclosed
US-20180062085-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2018-03-01 US disclosed
EP-3287451-A1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN ORGANIC OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2018-02-28 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 (3 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-20200212316-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OR10J3, OPRM1, OR51E2 SQOR 1580/4885ADORA1 4379/4885ADORA2A 3726/4885
US-10665792-B2 Organic molecules for use in optoelectronic devices OR10J3, CFD, AOX1 SQOR 225/4885ADORA1 4641/4885ADORA2A 4758/4885
US-11588114-B2 Organic molecules for use in optoelectronic devices OR10J3, OPRM1, OR51E2 SQOR 1580/4885ADORA1 4379/4885ADORA2A 3726/4885

“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.