SCHEMBL22155374

SCHEMBL22155374

Brc1cccc2c1oc1c(-c3ccc(C4(c5ccccc5)c5ccccc5-c5ccccc54)cc3)cccc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.40
KDM4E B2RXH2 3/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
MEN1 O00255 2/20 0.40
LMNA P02545 2/20 0.40
MAPT P10636 1/20 0.40
OPRK1 P41145 1/20 0.40
ESR1 P03372 1/20 0.35
ESR2 Q92731 1/20 0.35
ALOX5 P09917 1/20 0.35
ALDH1A1 P00352 4/20 0.34
MAPK1 P28482 1/20 0.34
POLB P06746 1/20 0.33
PRKDC P78527 4/20 0.31
PIK3CD O00329 3/20 0.30
PIK3CA P42336 3/20 0.30
PIK3CB P42338 3/20 0.30
PIK3CG P48736 3/20 0.30
BRD4 O60885 2/20 0.30
BRD2 P25440 2/20 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
SCHEMBL22155386 0.96 KDM4E (0.39) KMT2AKDM4ESMN1; SMN2MEN1LMNA
SCHEMBL440035 0.90 KDM4E (0.45) KMT2AKDM4ESMN1; SMN2MEN1LMNA
SCHEMBL437624 0.89 KDM4E (0.46) KMT2AKDM4ESMN1; SMN2MEN1LMNA
SCHEMBL440755 0.86 KDM4E (0.41) KMT2AKDM4ESMN1; SMN2MEN1LMNA
SCHEMBL438619 0.85 KDM4E (0.41) KMT2AKDM4ESMN1; SMN2MEN1LMNA
SCHEMBL22155388 0.84 ALOX5 (0.35) ALOX5ALDH1A1MAPK1
SCHEMBL437648 0.84 PRKDC (0.40) KMT2AKDM4ESMN1; SMN2MEN1LMNA
SCHEMBL371292 0.84 ALOX5 (0.51) KMT2AKDM4ESMN1; SMN2MEN1LMNA
SCHEMBL438618 0.84 ALOX5 (0.51) KMT2AKDM4ESMN1; SMN2MEN1LMNA
SCHEMBL29572728 0.84 ALOX5 (0.51) KMT2AKDM4ESMN1; SMN2MEN1LMNA

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-20220109116-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2022-04-07 US disclosed
WO-2020127176-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2020-06-25 WO 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-20220109116-A1 MATERIALS FOR ELECTRONIC DEVICES EED, EPHA6, ERCC1 KMT2A 1528/4885KDM4E 2653/4885SMN1; SMN2 2742/4885

“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.