SCHEMBL18227142

SCHEMBL18227142

CN(C)c1ccc2cc(-c3cc(F)cc(F)c3)c(N)nc2c1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 4/20 0.50
▸ TERT O14746 2/20 0.50
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ APAF1 O14727 1/20 0.40
▸ NPC1 O15118 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ EGFR P00533 1/20 0.39
▸ PSMB5 P28074 2/20 0.38
▸ FGFR1 P11362 2/20 0.36
▸ SRC P12931 1/20 0.36
▸ TCF4 P15884 1/20 0.36
▸ CTNNB1 P35222 1/20 0.36
▸ BACE1 P56817 1/20 0.36
▸ NOS1 P29475 2/20 0.35
▸ ADK P55263 1/20 0.34
▸ FYN P06241 1/20 0.33

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
SCHEMBL16739383 0.88 APP (0.50) APPTERTMEN1KMT2AAPAF1
SCHEMBL16739384 0.87 TERT (0.46) APPTERTMEN1KMT2ANPC1
SCHEMBL18226916 0.83 APP (0.47) APPTERTMEN1KMT2AAPAF1
SCHEMBL24800995 0.82 TERT (0.50) APPTERTMEN1KMT2AAPAF1
SCHEMBL18227090 0.80 APP (0.47) APPTERTMEN1KMT2AAPAF1
SCHEMBL18226918 0.80 APP (0.47) APPTERTAPAF1EGFRPSMB5
SCHEMBL18227091 0.79 TERT (0.50) APPTERTMEN1KMT2AAPAF1
SCHEMBL18227144 0.78 TERT (0.49) APPTERTMEN1KMT2AAPAF1
SCHEMBL16739391 0.78 TERT (0.49) APPTERTMEN1KMT2AAPAF1
SCHEMBL18227073 0.77 TERT (0.47) APPTERTMEN1KMT2AAPAF1

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-20160332971-A1 ARYLQUINOLINE, ARYLQUINOLONE AND ARYLTHIOQUINOLONE DERIVATIVES AND USE THEREOF TO TREAT CANCER UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION 2016-11-17 — — 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-20160332971-A1 ARYLQUINOLINE, ARYLQUINOLONE AND ARYLTHIOQUINOLONE DERIVATIVES AND USE THEREOF TO TREAT CANCER CASP4, PARP14, API5 APP 2258/4885TERT 1541/4885MEN1 3411/4885

“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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