SCHEMBL4373707

SCHEMBL4373707

Cc1ccccc1Nc1nccc(-c2cccnc2)n1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 12/20 0.72
BCR P11274 10/20 0.72
PRKCA P17252 4/20 0.70
EGFR P00533 5/20 0.68
PRKCD Q05655 1/20 0.68
PDGFRB P09619 6/20 0.65
PDGFRA P16234 6/20 0.65
KIT P10721 1/20 0.60
JAK3 P52333 1/20 0.60
BTK Q06187 1/20 0.60
ITK Q08881 1/20 0.60
NPC1 O15118 1/20 0.60
POLB P06746 1/20 0.60
RAB9A P51151 1/20 0.60
TDP1 Q9NUW8 1/20 0.60
CCNB2 O95067 1/20 0.58
CDK1 P06493 1/20 0.58
RET P07949 1/20 0.58
CCNB1 P14635 1/20 0.58
CCNB3 Q8WWL7 1/20 0.58

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
SCHEMBL22628286 0.86 ABL1 (0.70) ABL1BCRPRKCAEGFRPRKCD
SCHEMBL12320924 0.86 ABL1 (0.78) ABL1BCRPRKCAEGFRPDGFRB
SCHEMBL3085556 0.85 ABL1 (0.66) ABL1BCRPRKCAEGFRPRKCD
SCHEMBL7475168 0.85 CCNB2 (0.55) ABL1BCRPRKCAEGFRPRKCD
SCHEMBL7462310 0.84 ABL1 (0.68) ABL1BCRPRKCAEGFRPRKCD
SCHEMBL2392 0.84 ABL1 (1.00) ABL1BCRPRKCAEGFRPDGFRB
SCHEMBL29005835 0.84 ABL1 (0.75) ABL1BCRPRKCAEGFRPDGFRB
SCHEMBL3860532 0.84 ABL1 (0.83) ABL1BCRPRKCAEGFRPRKCD
SCHEMBL29366999 0.84 ABL1 (1.00) ABL1BCRPRKCAEGFRPDGFRB
SCHEMBL3210634 0.84 ABL1 (0.75) ABL1BCRPRKCAEGFRPDGFRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023066350-A1 CRBN E3 LIGASE LIGAND COMPOUND, PROTEIN DEGRADING AGENT DEVELOPED ON THE BASIS OF LIGAND COMPOUND, AND THEIR APPLICATIONS 标新生物医药科技(上海)有限公司 2023-04-27 WO claimed
WO-2009109991-A2 NOVEL HYDRAZIDE CONTAINING TYROSINE KINASE INHIBITORS SUN PHARMA ADVANCED RESEARCH COMPANY LTD., (IN) 2009-09-11 WO disclosed
WO-2009109991-A2 NOVEL HYDRAZIDE CONTAINING TYROSINE KINASE INHIBITORS SUN PHARMA ADVANCED RESEARCH COMPANY LTD., (IN) 2009-09-11 WO disclosed