SCHEMBL22157282

SCHEMBL22157282

N#Cc1c(-n2c3cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)ccc3c3ccc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cc32)ccc(-c2c(F)cccc2F)c1-n1c2cc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)ccc2c2ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc21

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.34
HIF1A Q16665 1/20 0.34
ADORA1 P30542 9/20 0.33
ADORA2A P29274 7/20 0.33
KDM4E B2RXH2 3/20 0.33
HPGD P15428 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
ADORA2B P29275 3/20 0.32
SQOR Q9Y6N5 1/20 0.32
HSD17B10 Q99714 2/20 0.32
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
ALDH1A1 P00352 2/20 0.31
LMNA P02545 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
TSHR P16473 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
SCHEMBL22157322 0.97 SMN1; SMN2 (0.33) SMN1; SMN2HIF1AADORA1ADORA2AKDM4E
SCHEMBL22156546 0.92 ADORA1 (0.33) SMN1; SMN2HIF1AADORA1ADORA2AKDM4E
SCHEMBL22157288 0.91 SQOR (0.32) SMN1; SMN2HIF1AADORA1ADORA2AKDM4E
SCHEMBL22157179 0.91 ADORA1 (0.33) SMN1; SMN2HIF1AADORA1ADORA2AKDM4E
SCHEMBL22157321 0.91 SMN1; SMN2 (0.35) SMN1; SMN2HIF1AADORA1ADORA2AKDM4E
SCHEMBL22158525 0.89 CYP11B1 (0.37) SMN1; SMN2HIF1AADORA1ADORA2AKDM4E
SCHEMBL22157245 0.88 SQOR (0.33) SMN1; SMN2HIF1AADORA1ADORA2AKDM4E
SCHEMBL22158560 0.88 SMN1; SMN2 (0.33) SMN1; SMN2HIF1AADORA1ADORA2ASQOR
SCHEMBL22156542 0.88 CLK4 (0.35) CLK4MAPK14
SCHEMBL22157130 0.87 ADORA1 (0.35) SMN1; SMN2HIF1AADORA1ADORA2AKDM4E

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-20200203628-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2020-06-25 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-20200203628-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES OR10J3, ORC3, OR51E2 SMN1; SMN2 4592/4885HIF1A 2459/4885ADORA1 4534/4885

“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.