SCHEMBL16739382

SCHEMBL16739382

CN(C)c1ccc2cc(-c3ccccc3F)cnc2c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 1/20 0.48
▸ BACE1 P56817 1/20 0.47
▸ GRIN2B Q13224 2/20 0.46
▸ NPC1 O15118 2/20 0.45
▸ TERT O14746 1/20 0.45
▸ APP P05067 1/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ RXFP1 Q9HBX9 1/20 0.45
▸ PDGFRB P09619 2/20 0.44
▸ PDGFRA P16234 2/20 0.44
▸ AKR1C3 P42330 2/20 0.43
▸ AKR1C2 P52895 2/20 0.43
▸ KDM1A O60341 1/20 0.42
▸ CYP1A2 P05177 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ CASP3 P42574 1/20 0.41
▸ SENP8 Q96LD8 1/20 0.41
▸ SENP7 Q9BQF6 1/20 0.41
▸ SENP6 Q9GZR1 1/20 0.41
▸ PSMB5 P28074 3/20 0.40

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
SCHEMBL16739391 0.74 TERT (0.49) EGFRBACE1NPC1TERTAPP
SCHEMBL16739386 0.74 TERT (0.49) EGFRBACE1NPC1TERTAPP
SCHEMBL18226915 0.72 TERT (0.46) EGFRBACE1NPC1TERTAPP
SCHEMBL28157132 0.72 PDGFRB (0.49) BACE1GRIN2BNPC1RAB9APDGFRB
SCHEMBL6480883 0.69 NPC1 (0.51) EGFRNPC1TERTAPPRAB9A
SCHEMBL29378182 0.69 CYP1A2 (0.64) APPPDGFRBPDGFRAKDM1ACYP1A2
SCHEMBL13356404 0.69 MAPT (0.43) EGFRNPC1APPRAB9ARXFP1
SCHEMBL14909225 0.68 EGFR (0.59) EGFRNPC1TERTAPPPDGFRB
SCHEMBL18227073 0.68 TERT (0.47) EGFRBACE1NPC1TERTAPP
SCHEMBL270025 0.66 TERT (0.59) EGFRNPC1TERTAPPRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9873670-B2 Arylquinoline and analog compounds and use thereof to treat cancer UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION (US) 2018-01-23 — — US claimed
US-20160280652-A1 ARYLQUINOLINE AND ANALOG COMPOUNDS AND USE THEREOF TO TREAT CANCER UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION 2016-09-29 — — US claimed
WO-2015077550-A1 ARYLQUINOLINE AND ANALOG COMPOUNDS AND USE THEREOF TO TREAT CANCER UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION (US) 2015-05-28 — — WO claimed
US-9873670-B2 Arylquinoline and analog compounds and use thereof to treat cancer UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION (US) 2018-01-23 — — US disclosed
US-20160280652-A1 ARYLQUINOLINE AND ANALOG COMPOUNDS AND USE THEREOF TO TREAT CANCER UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION 2016-09-29 — — US disclosed
US-20160280652-A1 ARYLQUINOLINE AND ANALOG COMPOUNDS AND USE THEREOF TO TREAT CANCER UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION 2016-09-29 — — US disclosed
WO-2015077550-A1 ARYLQUINOLINE AND ANALOG COMPOUNDS AND USE THEREOF TO TREAT CANCER UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION (US) 2015-05-28 — — 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 (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-20160280652-A1 ARYLQUINOLINE AND ANALOG COMPOUNDS AND USE THEREOF TO TREAT CANCER CASP4, BAD, BID EGFR 2088/4885BACE1 1123/4885GRIN2B 4440/4885

“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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