SCHEMBL6710865

SCHEMBL6710865

Cc1noc(C)c1C(=O)Nc1ccccn1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 1.00
L3MBTL1 Q9Y468 2/20 1.00
ALOX15 P16050 2/20 1.00
RAB9A P51151 4/20 0.60
SMN1; SMN2 Q16637 4/20 0.60
NPC1 O15118 3/20 0.60
CASP1 P29466 1/20 0.58
CASP7 P55210 1/20 0.58
HSD17B10 Q99714 1/20 0.58
CYP1A2 P05177 1/20 0.57
KMT2A Q03164 2/20 0.56
MEN1 O00255 1/20 0.56
GAA P10253 1/20 0.53
TP53 P04637 2/20 0.53
GFER P55789 1/20 0.52
HIF1A Q16665 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
SCHEMBL6707928 0.80 ALDH1A1 (0.66) ALDH1A1L3MBTL1ALOX15RAB9ASMN1; SMN2
SCHEMBL1519011 0.79 MAPK8 (0.65) ALDH1A1L3MBTL1ALOX15SMN1; SMN2CASP1
SCHEMBL27488058 0.79 L3MBTL1 (0.64) ALDH1A1L3MBTL1ALOX15RAB9ASMN1; SMN2
SCHEMBL12974858 0.76 ALDH1A1 (0.60) ALDH1A1L3MBTL1ALOX15RAB9ASMN1; SMN2
SCHEMBL27508819 0.75 RAB9A (0.70) ALDH1A1L3MBTL1ALOX15RAB9ASMN1; SMN2
SCHEMBL23657488 0.74 KMT2A (0.67) ALDH1A1L3MBTL1ALOX15SMN1; SMN2CASP1
SCHEMBL6709044 0.74 L3MBTL1 (0.59) ALDH1A1L3MBTL1ALOX15RAB9ASMN1; SMN2
SCHEMBL6707949 0.74 L3MBTL1 (0.59) ALDH1A1L3MBTL1ALOX15RAB9ASMN1; SMN2
SCHEMBL10192173 0.73 GFER (0.74) ALDH1A1L3MBTL1ALOX15RAB9ASMN1; SMN2
SCHEMBL2807153 0.73 RAB9A (1.00) ALDH1A1L3MBTL1ALOX15RAB9ASMN1; SMN2

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-20040102489-A1 Heteroarylcarboxamide compounds active against protein tyrosine kinase related disorders SUGEN, INC. 2004-05-27 US disclosed
US-6649635-B2 For therapy of cancer SUGEN, INC. 2003-11-18 US disclosed
US-20020065283-A1 Heteroarylcarboxamide compounds active against protein tyrosine kinase related disorders MCMAHON GERALD (US) 2002-05-30 US disclosed
EP-1012150-A4 HETEROARYLCARBOXAMIDE COMPOUNDS ACTIVE AGAINST PROTEIN TYROSINE KINASE RELATED DISORDERS SUGEN INC (US) 2002-05-29 EP disclosed
US-6316479-B1 ANTICANCER AGENTS SUGEN, INC. 2001-11-13 US disclosed
EP-1012150-A1 HETEROARYLCARBOXAMIDE COMPOUNDS ACTIVE AGAINST PROTEIN TYROSINE KINASE RELATED DISORDERS Sugen, Inc. (US) 2000-06-28 EP disclosed
WO-1998052944-A1 HETEROARYLCARBOXAMIDE COMPOUNDS ACTIVE AGAINST PROTEIN TYROSINE KINASE RELATED DISORDERS SUGEN, INC. (US) 1998-11-26 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-20020065283-A1 Heteroarylcarboxamide compounds active against protein tyrosine kinase related disorders ABL1, ERBB2, PRKDC ALDH1A1 3956/4885L3MBTL1 1271/4885ALOX15 4365/4885
US-20040102489-A1 Heteroarylcarboxamide compounds active against protein tyrosine kinase related disorders ABL1, ERBB2, PRKDC ALDH1A1 3956/4885L3MBTL1 1271/4885ALOX15 4365/4885

“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.