SCHEMBL21481685

SCHEMBL21481685

c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4cccc(-c5cccc(-c6cccc(-c7ccc8ccccc8c7)c6)c5)c4)c(-c4ccccc4)c3)n2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.46
ALDH1A1 P00352 3/20 0.46
KMT2A Q03164 3/20 0.46
KDM4E B2RXH2 3/20 0.46
TP53 P04637 1/20 0.46
CYP1A2 P05177 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HSD17B10 Q99714 1/20 0.46
HSD17B1 P14061 2/20 0.45
HSD17B2 P37059 2/20 0.45
GSTP1 P09211 1/20 0.43
CYP17A1 P05093 1/20 0.42
CYP19A1 P11511 1/20 0.42
CYP11B1 P15538 1/20 0.42
CYP11B2 P19099 1/20 0.42
ADORA2A P29274 2/20 0.42
ADORA1 P30542 2/20 0.42
CYP1A1 P04798 1/20 0.41
CYP1B1 Q16678 1/20 0.41
MAPT P10636 2/20 0.40

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
SCHEMBL21481213 1.00 MEN1 (0.46) MEN1ALDH1A1KMT2AKDM4ETP53
SCHEMBL26592319 1.00 MEN1 (0.46) MEN1ALDH1A1KMT2AKDM4ETP53
SCHEMBL26592309 1.00 MEN1 (0.46) MEN1ALDH1A1KMT2AKDM4ETP53
SCHEMBL26592245 0.98 MEN1 (0.45) MEN1ALDH1A1KMT2AKDM4ETP53
SCHEMBL26592321 0.98 MEN1 (0.45) MEN1ALDH1A1KMT2AKDM4ETP53
SCHEMBL26592320 0.98 MEN1 (0.45) MEN1ALDH1A1KMT2AKDM4ETP53
SCHEMBL26592315 0.98 MEN1 (0.45) MEN1ALDH1A1KMT2AKDM4ETP53
SCHEMBL26592310 0.98 MEN1 (0.45) MEN1ALDH1A1KMT2AKDM4ETP53
SCHEMBL26592316 0.98 MEN1 (0.45) MEN1ALDH1A1KMT2AKDM4ETP53
SCHEMBL26592247 0.98 MEN1 (0.45) MEN1ALDH1A1KMT2AKDM4ETP53

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-20190319197-A1 ORGANIC COMPOUND, APPLICATIONS THEREOF, ORGANIC MIXTURE, AND ORGANIC ELECTRONIC DEVICE GUANGZHOU CHINARAY OPTOELECTRONIC MATERIALS LTD. (CN) 2019-10-17 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-20190319197-A1 ORGANIC COMPOUND, APPLICATIONS THEREOF, ORGANIC MIXTURE, AND ORGANIC ELECTRONIC DEVICE PIEZO1, OR10J3, OR51E2 MEN1 828/4885ALDH1A1 108/4885KMT2A 3022/4885

“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.