SCHEMBL21866971

SCHEMBL21866971

c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(N(c4ccc5c(c4)c4ccccc4c4cc6c(cc54)sc4c(N(c5ccc(-c7nc(-c8ccccc8)nc(-c8ccccc8)n7)cc5)c5cccc7c5sc5ccccc57)cccc46)c4cccc5c4sc4ccccc45)cc3)n2)cc1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.33
TNKS O95271 1/20 0.31
TNKS2 Q9H2K2 1/20 0.31
ATM Q13315 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MAPT P10636 2/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
CYP1A2 P05177 1/20 0.30
GLA P06280 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C9 P11712 1/20 0.30
HPGD P15428 1/20 0.30
TSHR P16473 1/20 0.30
CYP2C19 P33261 1/20 0.30
RECQL P46063 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HIF1A Q16665 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
SCHEMBL21867742 0.88 ESR2 (0.32)
SCHEMBL21866723 0.87 PRKDC (0.32) ALOX5
SCHEMBL21866644 0.87 PRKDC (0.33) ALOX5
SCHEMBL16883044 0.87 ALOX5 (0.40) ALOX5TNKSTNKS2ATML3MBTL1
SCHEMBL21867229 0.86 ALOX5 (0.31) ALOX5
SCHEMBL21866720 0.86 PRKDC (0.30)
SCHEMBL25980468 0.86 LIMK1 (0.38) ALOX5ATMMAPTKDM4EALDH1A1
SCHEMBL25980465 0.85 LIMK1 (0.38) ALOX5ATMMAPTKDM4EALDH1A1
SCHEMBL15306094 0.84 ALOX5 (0.36) ALOX5TNKSTNKS2ATML3MBTL1
SCHEMBL25979547 0.83 PRKDC (0.36) ALOX5TNKSTNKS2ATML3MBTL1

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-20200115369-A1 INDENOTRIPHENYLENE-BASED AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME LUMINESCENCE TECHNOLOGY CORPORATION (TW) 2020-04-16 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-20200115369-A1 INDENOTRIPHENYLENE-BASED AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME ICMT, INMT, PNMT ALOX5 1299/4885TNKS 2495/4885TNKS2 2602/4885

“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.