SCHEMBL16629688

SCHEMBL16629688

CC1(C)c2cc(-c3ccccc3)ccc2N(c2cccc3ccc4cccnc4c23)c2ccc(-c3ccccc3)cc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.36
▸ MAPT P10636 4/20 0.36
▸ PDE6D O43924 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ ALDH1A1 P00352 3/20 0.35
▸ LMNA P02545 2/20 0.35
▸ HPGD P15428 1/20 0.35
▸ EGLN1 Q9GZT9 6/20 0.35
▸ CYP3A4 P08684 2/20 0.35
▸ TDP1 Q9NUW8 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ THRB P10828 1/20 0.34
▸ RECQL P46063 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ TOP1 P11387 3/20 0.34
▸ TEAD4 Q15561 1/20 0.34

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
SCHEMBL16629702 0.98 EGLN1 (0.36) KDM4EMAPTPDE6DNPSR1ALDH1A1
SCHEMBL16629682 0.86 PDE6D (0.39) KDM4EMAPTPDE6DALDH1A1LMNA
SCHEMBL16629689 0.84 PDE6D (0.37) KDM4EMAPTPDE6DNPSR1ALDH1A1
SCHEMBL16629698 0.82 PDE6D (0.43) KDM4EMAPTPDE6DNPSR1ALDH1A1
SCHEMBL16629690 0.82 KDM4E (0.36) KDM4EMAPTPDE6DNPSR1ALDH1A1
SCHEMBL16629674 0.81 PDE6D (0.45) KDM4EMAPTPDE6DNPSR1ALDH1A1
SCHEMBL16629673 0.81 PDE6D (0.37) KDM4EMAPTPDE6DNPSR1ALDH1A1
SCHEMBL30959798 0.81 AR (0.35) EGLN1TOP1
SCHEMBL16629743 0.81 EGLN1 (0.33) KDM4EMAPTPDE6DALDH1A1EGLN1
SCHEMBL24478915 0.78 CYP1A2 (0.36) KDM4EMAPTPDE6DALDH1A1HPGD

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 1939/4885MAPT 2400/4885PDE6D 3806/4885
US-10407394-B2 Triarylamine-substituted benzo[H]quinoline-derivatives as materials for electronic devices KCNQ1, KCNH1, KCNQ2 KDM4E 1939/4885MAPT 2400/4885PDE6D 3806/4885

“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.

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