SCHEMBL16629635

SCHEMBL16629635

c1cc(-c2cccc3ccc4cccnc4c23)cc(-n2c3ccccc3c3cc(-c4ccc5sc6ccccc6c5c4)ccc32)c1

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
ESR1 P03372 1/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
AGTR1 P30556 1/20 0.33
OPRM1 P35372 1/20 0.33
OPRD1 P41143 1/20 0.33
OPRK1 P41145 1/20 0.33
KMT2A Q03164 1/20 0.33
METAP2 P50579 1/20 0.31
NPY5R Q15761 1/20 0.30
ALK Q9UM73 1/20 0.30
PIM3 Q86V86 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
SCHEMBL16629625 0.93 ALK (0.33) KDM4EMEN1ALDH1A1LMNAESR1
SCHEMBL16629609 0.92 CCR1 (0.35) KDM4EMEN1LMNAMAPTKMT2A
SCHEMBL16629631 0.90 KDM4E (0.38) KDM4EALDH1A1LMNAMAPTMETAP2
SCHEMBL16629623 0.89 ALK (0.36) KDM4EALDH1A1LMNAMAPTMETAP2
SCHEMBL21622641 0.86 LMNA (0.40) KDM4EMEN1ALDH1A1LMNAESR1
SCHEMBL21622474 0.86 LMNA (0.41) KDM4EMEN1ALDH1A1LMNAESR1
SCHEMBL15317324 0.85 LIMK1 (0.35) KDM4ENPY5RPIM3
SCHEMBL16629895 0.85 KDM4E (0.36) KDM4EMEN1ALDH1A1LMNAESR1
SCHEMBL15317344 0.85 LIMK1 (0.34) KDM4ENPY5RPIM3
SCHEMBL17946241 0.84 METAP2 (0.36) KDM4ELMNAMAPTMETAP2NPY5R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10407394-B2 Triarylamine-substituted benzo[H]quinoline-derivatives as materials for electronic devices MERCK PATENT GMBH (DE) 2019-09-10 US disclosed
US-20160214942-A1 TRIARYLAMINE-SUBSTITUTED BENZO[H]QUINOLINE-DERIVATIVES AS MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2016-07-28 US disclosed
US-20160214942-A1 TRIARYLAMINE-SUBSTITUTED BENZO[H]QUINOLINE-DERIVATIVES AS MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2016-07-28 US disclosed
WO-2015049022-A1 TRIARYLAMINE-SUBSTITUTED BENZO[H]QUINOLINE-DERIVATIVES AS MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2015-04-09 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 (2 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-20160214942-A1 TRIARYLAMINE-SUBSTITUTED BENZO[H]QUINOLINE-DERIVATIVES AS MATERIALS FOR ELECTRONIC DEVICES KCNQ1, KCNH1, KCNQ2 KDM4E 1939/4885MEN1 1506/4885ALDH1A1 648/4885
US-10407394-B2 Triarylamine-substituted benzo[H]quinoline-derivatives as materials for electronic devices KCNQ1, KCNH1, KCNQ2 KDM4E 1939/4885MEN1 1506/4885ALDH1A1 648/4885

“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.