SCHEMBL1780333

SCHEMBL1780333

COc1ccc2c(c1)c(-c1cc3cccnc3[nH]1)cn2CC(=O)N1CCC(O)CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 3/20 0.46
SYK P43405 1/20 0.43
LCK P06239 2/20 0.42
GSK3A P49840 2/20 0.42
GSK3B P49841 2/20 0.42
CDK7 P50613 2/20 0.42
LRRK2 Q5S007 2/20 0.42
AURKB Q96GD4 2/20 0.42
JAK2 O60674 1/20 0.42
BTK Q06187 1/20 0.42
CDK1 P06493 2/20 0.42
CCNB1 P14635 2/20 0.42
CCNB2 O95067 1/20 0.42
RIPK1 Q13546 1/20 0.42
CCNB3 Q8WWL7 1/20 0.42
DRD2 P14416 2/20 0.41
DRD3 P35462 2/20 0.41
RAB9A P51151 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41

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
SCHEMBL1780095 0.92 IGF1R (0.48) IGF1RSYKLCKGSK3AGSK3B
SCHEMBL1777094 0.91 IGF1R (0.48) IGF1RSYKLCKGSK3AGSK3B
SCHEMBL1778546 0.90 IGF1R (0.49) IGF1RSYKLCKGSK3AGSK3B
SCHEMBL1778957 0.90 CBX7 (0.44) IGF1RSYKLCKGSK3AGSK3B
SCHEMBL1778184 0.89 RAB9A (0.49) IGF1RSYKLCKGSK3AGSK3B
SCHEMBL1779504 0.89 IGF1R (0.47) IGF1RSYKLCKGSK3AGSK3B
SCHEMBL1748763 0.89 IGF1R (0.58) IGF1RSYKRIPK1CDK9CCNT1
SCHEMBL1779372 0.88 IGF1R (0.48) IGF1RSYKLCKGSK3AGSK3B
SCHEMBL1777330 0.88 POLB (0.46) IGF1RSYKLCKGSK3AGSK3B
SCHEMBL1777457 0.87 G6PD (0.48) IGF1RSYKLCKGSK3AGSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050267304-A1 Protein kinase inhibitors; astham; psoriasis; antiinflammatory agents; inflammatory bowel disorders AVENTIS PHARMACEUTICALS INC. (US) 2005-12-01 US claimed
US-6897207-B2 Azaindoles AVENTIS PHARMACEUTICALS INC. (US) 2005-05-24 US claimed
US-20040053931-A1 Azaindoles AVENTIS PHARMACEUTICALS INC. 2004-03-18 US claimed
EP-1397360-A1 AZAINDOLES Aventis Pharma Limited (GB) 2004-03-17 EP claimed
WO-2003000688-A1 AZAINDOLES AVENTIS PHARMA LIMITED (GB) 2003-01-03 WO claimed
US-7943616-B2 Protein kinase inhibitors; astham; psoriasis; antiinflammatory agents; inflammatory bowel disorders AVENTIS PHARMACEUTICALS INC. (US) 2011-05-17 US disclosed
US-7943616-B2 Protein kinase inhibitors; astham; psoriasis; antiinflammatory agents; inflammatory bowel disorders AVENTIS PHARMACEUTICALS INC. (US) 2011-05-17 US disclosed
US-7943616-B2 Protein kinase inhibitors; astham; psoriasis; antiinflammatory agents; inflammatory bowel disorders AVENTIS PHARMACEUTICALS INC. (US) 2011-05-17 US disclosed
EP-2233486-A1 Azaindoles Aventis Pharma Limited (GB) 2010-09-29 EP disclosed
EP-2233486-A1 Azaindoles Aventis Pharma Limited (GB) 2010-09-29 EP disclosed
US-20050267304-A1 Protein kinase inhibitors; astham; psoriasis; antiinflammatory agents; inflammatory bowel disorders AVENTIS PHARMACEUTICALS INC. (US) 2005-12-01 US disclosed
US-6897207-B2 Azaindoles AVENTIS PHARMACEUTICALS INC. (US) 2005-05-24 US disclosed
US-20040053931-A1 Azaindoles AVENTIS PHARMACEUTICALS INC. 2004-03-18 US disclosed
EP-1397360-A1 AZAINDOLES Aventis Pharma Limited (GB) 2004-03-17 EP disclosed
WO-2003000688-A1 AZAINDOLES AVENTIS PHARMA LIMITED (GB) 2003-01-03 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-20040053931-A1 Azaindoles CDKN1A, CDK7, CDK2 IGF1R 1574/4885SYK 836/4885LCK 155/4885
US-20050267304-A1 Protein kinase inhibitors; astham; psoriasis; antiinflammatory agents; inflammatory bowel disorders MAP3K20, MAP3K12, MAP3K19 IGF1R 1245/4885SYK 113/4885LCK 66/4885

“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.