SCHEMBL14901036

SCHEMBL14901036

Cc1ccc2c(c1)C(=O)N(c1cccc(N)c1)C2=O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.67
CASP1 P29466 3/20 0.67
NPC1 O15118 2/20 0.67
TSHR P16473 2/20 0.67
RAB9A P51151 2/20 0.67
CASP7 P55210 2/20 0.67
HSD17B10 Q99714 1/20 0.67
MEN1 O00255 5/20 0.57
KMT2A Q03164 5/20 0.57
MAPK1 P28482 2/20 0.57
NPSR1 Q6W5P4 1/20 0.57
USP2 O75604 2/20 0.57
KEAP1 Q14145 2/20 0.57
NFE2L2 Q16236 2/20 0.57
ANPEP P15144 2/20 0.55
DPP4 P27487 1/20 0.55
CA9 Q16790 3/20 0.55
CA12 O43570 2/20 0.55
CA1 P00915 2/20 0.55
CA2 P00918 1/20 0.55

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
SCHEMBL2601911 0.89 CA9 (0.59) ALDH1A1CASP1NPC1TSHRRAB9A
SCHEMBL9566664 0.87 NPC1 (0.65) ALDH1A1CASP1NPC1TSHRRAB9A
SCHEMBL13910988 0.83 KMT2A (0.67) ALDH1A1CASP1NPC1TSHRRAB9A
SCHEMBL30231754 0.82 CA9 (0.69) ALDH1A1CASP1NPC1TSHRRAB9A
SCHEMBL9468849 0.82 NPC1 (0.67) ALDH1A1CASP1NPC1TSHRRAB9A
SCHEMBL8604716 0.82 CA9 (0.69) ALDH1A1CASP1NPC1TSHRRAB9A
SCHEMBL9453218 0.81 MEN1 (0.57) ALDH1A1CASP1NPC1TSHRRAB9A
SCHEMBL2631561 0.81 ESR1 (0.77) ALDH1A1CASP1NPC1TSHRRAB9A
SCHEMBL9566635 0.81 KMT2A (0.57) ALDH1A1CASP1NPC1TSHRRAB9A
SCHEMBL4781427 0.80 ALDH1A1 (1.00) ALDH1A1CASP1NPC1TSHRRAB9A

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-9255181-B2 Solventless process for the preparation of amine functional polyetherimide resins with improved melt flow SABIC GLOBAL TECHNOLOGIES B.V. (NL) 2016-02-09 US disclosed
US-20140213739-A1 SOLVENTLESS PROCESS FOR THE PREPARATION OF AMINE FUNCTIONAL POLYETHERIMIDE RESINS WITH IMPROVED MELT FLOW SABIC INNOVATIVE PLASTICS IP B.V. (NE) 2014-07-31 US disclosed
US-8722187-B2 Solventless process for the preparation of amine functional polyetherimide resins with improved melt flow SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2014-05-13 US disclosed
US-20130108854-A1 SOLVENTLESS PROCESS FOR THE PREPARATION OF AMINE FUNCTIONAL POLYETHERIMIDE RESINS WITH IMPROVED MELT FLOW SHPP GLOBAL TECHNOLOGIES B.V. (NL) 2013-05-02 US disclosed