SCHEMBL21999334

SCHEMBL21999334

c1ccc(-c2ccc(N(c3ccc(-c4ccc5oc6cccc(-c7nc(-c8ccccc8)nc(-c8ccccc8)n7)c6c5c4)cc3)c3cccc4c3oc3ccccc34)cc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.37
PIM1 P11309 1/20 0.36
CSNK2A2 P19784 1/20 0.36
CSNK2B P67870 1/20 0.36
PIM3 Q86V86 1/20 0.36
PIM2 Q9P1W9 1/20 0.36
MAPT P10636 7/20 0.35
POLB P06746 3/20 0.35
LMNA P02545 3/20 0.35
TSHR P16473 2/20 0.35
KMT2A Q03164 2/20 0.35
HTT P42858 1/20 0.35
PLA2G2A P14555 3/20 0.35
PLA2G4A P47712 3/20 0.35
ALDH1A1 P00352 4/20 0.34
HPGD P15428 2/20 0.34
KDM4E B2RXH2 1/20 0.34
PLA2G10 O15496 1/20 0.34
PTPRF P10586 2/20 0.33
PTPN2 P17706 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
SCHEMBL21999347 0.93 ALOX5 (0.40) ALOX5PIM1CSNK2A2CSNK2BPIM3
SCHEMBL21999481 0.92 ALOX5 (0.42) ALOX5PIM1CSNK2A2CSNK2BPIM3
SCHEMBL21999592 0.92 ALOX5 (0.42) ALOX5PIM1CSNK2A2CSNK2BPIM3
SCHEMBL25980374 0.91 ALOX5 (0.37) ALOX5PIM1CSNK2A2CSNK2BPIM3
SCHEMBL24255669 0.91 ALOX5 (0.37) ALOX5PIM1CSNK2A2CSNK2BPIM3
SCHEMBL21999319 0.91 PLA2G2A (0.37) PIM1CSNK2A2CSNK2BPIM3PIM2
SCHEMBL22000218 0.89 PLA2G2A (0.35) PIM1CSNK2A2CSNK2BPIM3PIM2
SCHEMBL22000216 0.89 PLA2G2A (0.38) PIM1CSNK2A2CSNK2BPIM3PIM2
SCHEMBL24899588 0.89 MAPT (0.35) ALOX5MAPTPOLBLMNATSHR
SCHEMBL26779114 0.89 MAPT (0.36) ALOX5PIM1CSNK2A2CSNK2BPIM3

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-20200152883-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2020-05-14 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-20200152883-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES DDT, TRDMT1, ESD ALOX5 1482/4885PIM1 2050/4885CSNK2A2 4560/4885

“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.