SCHEMBL16629611

SCHEMBL16629611

CC1(C)c2cc3c(cc2-c2cc4c5ccccc5n(-c5cccc(-c6cccc7ccc8cccnc8c67)c5)c4cc21)c1ccccc1n3-c1cccc(-c2cccc3ccc4cccnc4c23)c1

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FABP1 P07148 1/20 0.32
METAP2 P50579 1/20 0.32
PIK3R2 O00459 1/20 0.30
AVPR2 P30518 1/20 0.30
AVPR1A P37288 1/20 0.30
PDE4A P27815 1/20 0.30
PDE4D Q08499 1/20 0.30
CCR1 P32246 2/20 0.30
CCR8 P51685 2/20 0.30
KDM4E B2RXH2 1/20 0.30
GMNN O75496 1/20 0.30
LMNA P02545 1/20 0.30
TP53 P04637 1/20 0.30
HSP90AA1 P07900 1/20 0.30
MMP2 P08253 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 1/20 0.30
MAPT P10636 1/20 0.30
MMP9 P14780 1/20 0.30
ALOX15 P16050 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
SCHEMBL16629617 0.97 FABP1 (0.31) FABP1METAP2
SCHEMBL16629627 0.90 AVPR2 (0.32) METAP2AVPR2AVPR1A
SCHEMBL16629770 0.90 METAP2 (0.32) METAP2
SCHEMBL16629640 0.89 KDM4E (0.31) KDM4EMAPT
SCHEMBL16629616 0.89 ALK (0.32) FABP1METAP2
SCHEMBL16629632 0.87 METAP2 (0.33) METAP2MAPTHTT
SCHEMBL16629633 0.87
SCHEMBL17945951 0.87
SCHEMBL15930431 0.86 HTR2A (0.31) PDE4APDE4D
SCHEMBL16629619 0.86

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 FABP1 4848/4885METAP2 3484/4885PIK3R2 4165/4885
US-10407394-B2 Triarylamine-substituted benzo[H]quinoline-derivatives as materials for electronic devices KCNQ1, KCNH1, KCNQ2 FABP1 4848/4885METAP2 3484/4885PIK3R2 4165/4885

“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.