SCHEMBL14883375

SCHEMBL14883375

Cc1ccc2nc(-c3cccc4ccccc34)[nH]c(=O)c2c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 2/20 0.58
▸ RAB9A P51151 2/20 0.58
▸ TNKS O95271 2/20 0.55
▸ PARP1 P09874 2/20 0.55
▸ TNKS2 Q9H2K2 2/20 0.55
▸ TUBB4A P04350 1/20 0.52
▸ TUBB P07437 1/20 0.52
▸ TUBA3C P0DPH7 1/20 0.52
▸ TUBA1B P68363 1/20 0.52
▸ TUBA4A P68366 1/20 0.52
▸ TUBB4B P68371 1/20 0.52
▸ TUBB3 Q13509 1/20 0.52
▸ TUBB2A Q13885 1/20 0.52
▸ TUBB8 Q3ZCM7 1/20 0.52
▸ TUBA3E Q6PEY2 1/20 0.52
▸ TUBA1A Q71U36 1/20 0.52
▸ TUBA1C Q9BQE3 1/20 0.52
▸ TUBB6 Q9BUF5 1/20 0.52
▸ TUBB2B Q9BVA1 1/20 0.52
▸ TUBB1 Q9H4B7 1/20 0.52

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
SCHEMBL4080197 0.86 TUBB4A (0.54) NPC1RAB9ATNKSPARP1TNKS2
SCHEMBL28135155 0.84 GUSB (0.69) NPC1RAB9ATNKSPARP1TNKS2
SCHEMBL4090569 0.84 GUSB (0.70) NPC1RAB9ATNKSPARP1TNKS2
SCHEMBL7012552 0.84 TUBB4A (0.52) NPC1RAB9ATNKSPARP1TNKS2
SCHEMBL14876859 0.83 GUSB (0.63) NPC1RAB9ATNKSPARP1TNKS2
SCHEMBL14877275 0.83 GUSB (0.57) NPC1RAB9ATNKSPARP1TNKS2
SCHEMBL11826929 0.81 TNKS (0.70) NPC1RAB9ATNKSPARP1TNKS2
SCHEMBL14883366 0.81 TNKS (0.51) NPC1RAB9ATNKSPARP1TNKS2
SCHEMBL14883377 0.80 TNKS (0.50) NPC1RAB9ATNKSPARP1TNKS2
SCHEMBL31399890 0.80 GUSB (0.61) NPC1RAB9ATNKSPARP1TNKS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9045437-B2 2-aryl-4-quinazolinones and their pharmaceutical compositions CHINA MEDICAL UNIVERSITY (TW) 2015-06-02 — — US disclosed
US-9006239-B2 2-aryl-4-quinazolinones and their pharmaceutical compositions CHINA MEDICAL UNIVERSITY (TW) 2015-04-14 — — US disclosed
US-20140018363-A1 2-ARYL-4-QUINAZOLINONES AND THEIR PHARMACEUTICAL COMPOSITIONS CHINA MEDICAL UNIVERSITY (TW) 2014-01-16 — — US disclosed
US-20130310376-A1 2-ARYL-4-QUINAZOLINONES AND THEIR PHARMACEUTICAL COMPOSITIONS CHINA MEDICAL UNIVERSITY (TW) 2013-11-21 — — US disclosed
US-20130102602-A1 2-Aryl-4-Quinazolinones And Their Pharmaceutical Compositions CHINA MEDICAL UNIVERSITY (TW) 2013-04-25 — — 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 (3 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-20130102602-A1 2-Aryl-4-Quinazolinones And Their Pharmaceutical Compositions AQP4, KRAS, RB1 NPC1 765/4885RAB9A 257/4885TNKS 3904/4885
US-20130310376-A1 2-ARYL-4-QUINAZOLINONES AND THEIR PHARMACEUTICAL COMPOSITIONS CCNE2, NFE2, NR2E1 NPC1 1746/4885RAB9A 468/4885TNKS 3069/4885
US-20140018363-A1 2-ARYL-4-QUINAZOLINONES AND THEIR PHARMACEUTICAL COMPOSITIONS CCNE2, RB1, NR2E1 NPC1 1718/4885RAB9A 588/4885TNKS 3632/4885

“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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