SCHEMBL22146643

SCHEMBL22146643

Brc1cccc2c1-c1ccccc1C2(c1ccccc1)c1ccc(-c2cccc3c2oc2ccccc23)cc1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.43
PDK2 Q15119 1/20 0.35
PRKDC P78527 3/20 0.34
GGPS1 O95749 1/20 0.34
PTGES2 Q9H7Z7 1/20 0.34
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
OPRK1 P41145 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CDC14B O60729 2/20 0.30
CDC14A Q9UNH5 2/20 0.30
PIK3CD O00329 1/20 0.30
PIK3CB P42338 1/20 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
SCHEMBL22146665 0.97 ALOX5 (0.43) ALOX5PDK2PRKDCGGPS1PTGES2
SCHEMBL24434074 0.90 ALOX5 (0.40) ALOX5PDK2PRKDCGGPS1PTGES2
SCHEMBL29572728 0.88 ALOX5 (0.51) ALOX5PRKDCGGPS1PTGES2KDM4E
SCHEMBL371292 0.88 ALOX5 (0.51) ALOX5PRKDCGGPS1PTGES2KDM4E
SCHEMBL438618 0.88 ALOX5 (0.51) ALOX5PRKDCGGPS1PTGES2KDM4E
SCHEMBL24434019 0.87 ALOX5 (0.37) ALOX5PDK2PRKDCPIK3CDPIK3CB
SCHEMBL438612 0.87 ALOX5 (0.50) ALOX5PRKDCGGPS1PTGES2KDM4E
SCHEMBL22146664 0.85 MMP12 (0.36) ALOX5PDK2PRKDCKDM4EMEN1
SCHEMBL437623 0.85 ALOX5 (0.54) ALOX5PRKDCGGPS1PTGES2KDM4E
SCHEMBL17036992 0.84 ALOX5 (0.50) ALOX5PRKDCGGPS1PTGES2KDM4E

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-20220158101-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2022-05-19 US disclosed
WO-2020127259-A2 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-20220158101-A1 MATERIALS FOR ELECTRONIC DEVICES EED, EPHA6, ERCC1 ALOX5 3331/4885PDK2 519/4885PRKDC 1570/4885

“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.