SCHEMBL21343397

SCHEMBL21343397

CC1(C)c2ccccc2-c2c1c1c(c3c2oc2ccccc23)-c2ccccc2C1(C)C

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.35
MEN1 O00255 1/20 0.35
CYP2C19 P33261 1/20 0.35
KMT2A Q03164 1/20 0.35
PGR P06401 1/20 0.35
MAOA P21397 4/20 0.33
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
NPC1 O15118 1/20 0.33
LMNA P02545 1/20 0.33
RAB9A P51151 1/20 0.33
NTRK1 P04629 1/20 0.32
PLK3 Q9H4B4 1/20 0.32
KDM5A P29375 1/20 0.32
MAP3K11 Q16584 1/20 0.32
CDC14B O60729 1/20 0.31
CDC14A Q9UNH5 1/20 0.31
GAA P10253 1/20 0.31
HPGD P15428 1/20 0.31
HSD17B10 Q99714 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
SCHEMBL19107950 0.90 ALOX5 (0.35) ALOX5MEN1CYP2C19KMT2APGR
SCHEMBL19107947 0.90 ALOX5 (0.38) ALOX5MEN1CYP2C19KMT2APGR
SCHEMBL21343398 0.89 AHR (0.38) ALOX5MEN1KMT2APGRMAOA
SCHEMBL21344437 0.89 ALOX5 (0.36) ALOX5CDC14BCDC14AALK
SCHEMBL21343243 0.89 AHR (0.38) ALOX5MEN1KMT2APGRMAOA
SCHEMBL22859813 0.88 ALOX5 (0.34) ALOX5ALK
SCHEMBL21344441 0.86 ALOX5 (0.34) ALOX5MEN1KMT2AKDM4ECDC14B
SCHEMBL21350255 0.86 ALK (0.33) ALOX5ALK
SCHEMBL21343245 0.86 ALOX5 (0.34) ALOX5MEN1KMT2AKDM4ECDC14B
SCHEMBL21343977 0.86 ALOX5 (0.34) ALOX5PGRCDC14BCDC14AALK

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
US-20210005821-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2021-01-07 US disclosed
WO-2019170578-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2019-09-12 WO disclosed
WO-2019170572-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2019-09-12 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-20210005821-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES L1CAM, EFNA1, EPCAM ALOX5 1831/4885MEN1 331/4885CYP2C19 287/4885

“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.