SCHEMBL17752686

SCHEMBL17752686

c1ccc(-c2ccc(N(c3ccc(-c4cccc5c4oc4ccccc45)cc3)c3nc4ccccc4c4ccccc34)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.44
GGPS1 O95749 1/20 0.36
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 2/20 0.35
POLB P06746 2/20 0.35
PRKDC P78527 3/20 0.35
PIK3CD O00329 2/20 0.35
PIK3CB P42338 2/20 0.35
JAK2 O60674 1/20 0.34
JAK1 P23458 1/20 0.34
TYK2 P29597 1/20 0.34
PTGES2 Q9H7Z7 1/20 0.34
DHODH Q02127 1/20 0.34
PIK3CA P42336 1/20 0.34
PIK3CG P48736 1/20 0.34
KDM1A O60341 1/20 0.34
CDC14B O60729 1/20 0.33
CDC14A Q9UNH5 1/20 0.33
MAPT P10636 4/20 0.33
KMT2A Q03164 2/20 0.33

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
SCHEMBL17752656 0.98 ALOX5 (0.46) ALOX5GGPS1KDM4EALDH1A1POLB
SCHEMBL17752669 0.97 ALOX5 (0.44) ALOX5GGPS1KDM4EALDH1A1POLB
SCHEMBL17752657 0.95 ALOX5 (0.43) ALOX5GGPS1KDM4EALDH1A1POLB
SCHEMBL17752851 0.92 ALOX5 (0.42) ALOX5GGPS1KDM4EALDH1A1POLB
SCHEMBL21709456 0.89 CYP1A2 (0.47) ALOX5KDM4EALDH1A1POLBKDM1A
SCHEMBL21709455 0.87 CYP1A2 (0.48) ALOX5KDM4EALDH1A1POLBMAPT
SCHEMBL17752663 0.87 ALOX5 (0.43) ALOX5GGPS1KDM4EALDH1A1POLB
SCHEMBL17752658 0.86 ALOX5 (0.39) ALOX5GGPS1PRKDCPIK3CDPIK3CB
SCHEMBL25132623 0.85 ALOX5 (0.55) ALOX5GGPS1KDM4EALDH1A1PRKDC
SCHEMBL21131445 0.85 ALOX5 (0.55) ALOX5GGPS1KDM4EALDH1A1PRKDC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3218368-B1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2020-11-25 EP disclosed
US-10577342-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2020-03-03 US disclosed
WO-2016074755-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2016-05-19 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-10577342-B2 Materials for organic electroluminescent devices PIEZO1, L1CAM, EFNA1 ALOX5 2222/4885GGPS1 848/4885KDM4E 3135/4885

“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.