SCHEMBL1778522

SCHEMBL1778522

COc1ccc(-c2cc3cccnc3[nH]2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 18/20 1.00
CCNB2 O95067 2/20 1.00
CDK1 P06493 2/20 1.00
CCNB1 P14635 2/20 1.00
CCNB3 Q8WWL7 2/20 1.00
GSK3A P49840 1/20 0.64
GSK3B P49841 1/20 0.64
CDK5 Q00535 1/20 0.64
CDK5R1 Q15078 1/20 0.64
KDM4E B2RXH2 1/20 0.59
NPC1 O15118 1/20 0.59
MAPT P10636 1/20 0.59
CASP3 P42574 1/20 0.59
RAB9A P51151 1/20 0.59
SENP8 Q96LD8 1/20 0.59
SENP7 Q9BQF6 1/20 0.59
SENP6 Q9GZR1 1/20 0.59

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
SCHEMBL31064954 1.00 RIPK1 (1.00) RIPK1CCNB2CDK1CCNB1CCNB3
SCHEMBL18741078 0.85 RIPK1 (0.74) RIPK1CCNB2CDK1CCNB1CCNB3
SCHEMBL28043442 0.85 RIPK1 (0.74) RIPK1CCNB2CDK1CCNB1CCNB3
SCHEMBL18767004 0.84 RIPK1 (0.72) RIPK1CCNB2CDK1CCNB1CCNB3
SCHEMBL31064970 0.84 RIPK1 (1.00) RIPK1CCNB2CDK1CCNB1CCNB3
SCHEMBL31065006 0.84 RIPK1 (1.00) RIPK1CCNB2CDK1CCNB1CCNB3
SCHEMBL24655593 0.83 RIPK1 (0.71) RIPK1CCNB2CDK1CCNB1CCNB3
SCHEMBL1778505 0.80 RIPK1 (0.74) RIPK1CCNB2CDK1CCNB1CCNB3
SCHEMBL4765770 0.80 RIPK1 (0.67) RIPK1CCNB2CDK1CCNB1CCNB3
SCHEMBL30472919 0.80 ADORA2A (0.70) RIPK1CCNB2CDK1CCNB1CCNB3

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 35 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1990343-A2 Azaindoles Aventis Pharma Limited (GB) 2008-11-12 EP claimed
US-20050267304-A1 Protein kinase inhibitors; astham; psoriasis; antiinflammatory agents; inflammatory bowel disorders AVENTIS PHARMACEUTICALS INC. (US) 2005-12-01 US claimed
US-20040198737-A1 Azaindoles AVENTIS PHARMA LIMITED (GB) 2004-10-07 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
US-20040009983-A1 Azaindoles AVENTIS PHARMA LIMITED (GB) 2004-01-15 US claimed
WO-2003000688-A1 AZAINDOLES AVENTIS PHARMA LIMITED (GB) 2003-01-03 WO claimed
EP-1263759-A2 AZAINDOLES Aventis Pharma Limited (GB) 2002-12-11 EP claimed
WO-2001047922-A2 AZAINDOLES AVENTIS PHARMA LIMITED (GB) 2001-07-05 WO claimed
US-20240116923-A1 USE OF INDOLE, 6- AND 7-AZAINDOLE DERIVATIVES AS INHIBITORS OF FERROPTOSIS REGULATED CELL DEATH SEABELIFE (FR) 2024-04-11 US disclosed
CN-117529317-A Use of indole, 6-and 7-azaindole derivatives as inhibitors of iron death-mediated cell death 海洋生命公司 2024-02-06 CN disclosed
EP-4281070-A1 USE OF INDOLE, 6- AND 7-AZAINDOLE DERIVATIVES AS INHIBITORS OF FERROPTOSIS REGULATED CELL DEATH Seabelife (FR) 2023-11-29 EP disclosed
WO-2022157392-A1 USE OF INDOLE, 6- AND 7-AZAINDOLE DERIVATIVES AS INHIBITORS OF FERROPTOSIS REGULATED CELL DEATH SEABELIFE (FR) 2022-07-28 WO disclosed
EP-3362449-B1 SIBIRILINE DERIVATIVES FOR USE FOR PREVENTING AND/OR TREATING DISORDERS ASSOCIATED WITH CELLULAR NECROPTOSIS INST NAT SANTE RECH MED (FR) 2021-06-16 EP 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
US-20040009983-A1 Azaindoles AVENTIS PHARMA LIMITED (GB) 2004-01-15 US disclosed
WO-2003000688-A1 AZAINDOLES AVENTIS PHARMA LIMITED (GB) 2003-01-03 WO disclosed
EP-1263759-A2 AZAINDOLES Aventis Pharma Limited (GB) 2002-12-11 EP disclosed
WO-2001047922-A2 AZAINDOLES AVENTIS PHARMA LIMITED (GB) 2001-07-05 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 (5 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-20040198737-A1 Azaindoles CCNY, CCNO, CNKSR1 RIPK1 2247/4885CCNB2 194/4885CDK1 8/4885
US-20040053931-A1 Azaindoles CDKN1A, CDK7, CDK2 RIPK1 1614/4885CCNB2 381/4885CDK1 5/4885
US-20240116923-A1 USE OF INDOLE, 6- AND 7-AZAINDOLE DERIVATIVES AS INHIBITORS OF FERROPTOSIS REGULATED CELL DEATH AIFM2, SLC40A1, FECH RIPK1 76/4885CCNB2 3377/4885CDK1 2114/4885
US-20040009983-A1 Azaindoles CCNY, CCNO, CKS2 RIPK1 1843/4885CCNB2 244/4885CDK1 13/4885
US-20050267304-A1 Protein kinase inhibitors; astham; psoriasis; antiinflammatory agents; inflammatory bowel disorders MAP3K20, MAP3K12, MAP3K19 RIPK1 278/4885CCNB2 1015/4885CDK1 37/4885

“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.