SCHEMBL29571097

SCHEMBL29571097

CCN1CCN(Cc2ccc(NC(=O)c3ccc(C)c(C#Cc4cccnc4)c3)cc2C(F)(F)F)CC1

nearest known ligand 0.89

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ABL1 P00519 8/20 0.89
▸ KIT P10721 6/20 0.89
▸ RET P07949 1/20 0.75
▸ FGFR1 P11362 5/20 0.70
▸ KDR P35968 5/20 0.70
▸ DDR1 Q08345 1/20 0.66

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
SCHEMBL20136957 1.00 ABL1 (0.89) ABL1KITRETFGFR1KDR
SCHEMBL13765778 0.94 KIT (1.00) ABL1KITRETFGFR1KDR
SCHEMBL13765894 0.92 ABL1 (0.85) ABL1KITRETFGFR1KDR
SCHEMBL21730713 0.86 RET (1.00) ABL1KITRETFGFR1KDR
SCHEMBL4112245 0.85 ABL1 (1.00) ABL1KITFGFR1KDR
SCHEMBL28054441 0.85 ABL1 (0.69) ABL1KIT
SCHEMBL24626380 0.84 KIT (0.79) ABL1KITFGFR1KDR
SCHEMBL29675251 0.84 KIT (0.79) ABL1KITFGFR1KDR
SCHEMBL19317717 0.84 ABL1 (0.84) ABL1KITFGFR1KDRDDR1
SCHEMBL10207549 0.84 ABL1 (0.90) ABL1KITRETFGFR1KDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4558505-A2 CYCLIC COMPOUNDS AND METHODS OF USING SAME Schrödinger, Inc. (US) 2025-05-28 — — EP disclosed
WO-2025059027-A1 CYCLOPENTA[E]PYRAZOLO[1,5-A]PYRIMIDINE DERIVATIVES AS MALT1 INHIBITORS SCHRÖDINGER, INC. (US) 2025-03-20 — — WO disclosed
CN-114163437-B Substituted pyrazolo [1,5-a ] pyridine compounds as RET kinase inhibitors 阿雷生物药品公司 2025-03-04 — — CN disclosed
CN-118319866-A Formulations comprising RET kinase inhibitors 罗索肿瘤学公司 2024-07-12 — — CN disclosed
CN-118234498-A STING modulators, compositions, and methods of use thereof 南佛罗里达大学 2024-06-21 — — CN disclosed
WO-2024020534-A2 CYCLIC COMPOUNDS AND METHODS OF USING SAME SCHRÖDINGER, INC. (US) 2024-01-25 — — WO disclosed
EP-4308573-A1 CYCLIC COMPOUNDS AND METHODS OF USING SAME Schrödinger, Inc. (US) 2024-01-24 — — EP disclosed
CN-117120442-A Tricyclic compounds useful for treating cancer, autoimmune disorders, and inflammatory disorders 薛定谔公司 2023-11-24 — — CN disclosed
CN-117120447-A Cyclic compounds and methods of use thereof 薛定谔公司 2023-11-24 — — CN disclosed
CN-116490507-A Heterocyclic condensation CDC7 kinase inhibitors for the treatment of cancer 薛定谔公司 2023-07-25 — — CN disclosed
CN-111971286-B Substituted pyrrolo [2,3-d ] pyrimidine compounds as RET kinase inhibitors 阿雷生物药品公司 2023-04-14 — — CN disclosed
WO-2023034587-A1 STING Modulators, Compositions, and Methods of Use UNIVERSITY OF SOUTH FLORIDA (US) 2023-03-09 — — WO disclosed
EP-4081526-A1 CYCLIC COMPOUNDS AND METHODS OF USING SAME Schrödinger, Inc. (US) 2022-11-02 — — EP disclosed
CN-111278822-B Crystalline forms 阿雷生物药品公司 2022-10-21 — — CN disclosed
EP-4069369-A1 CYCLIC COMPOUNDS AND METHODS OF USING SAME Schrödinger, Inc. (US) 2022-10-12 — — EP disclosed
CN-111615514-B Substituted pyrazolo [4,3-C ] pyridine compounds as RET kinase inhibitors 奥瑞生物药品公司 2022-10-11 — — CN disclosed
WO-2022197898-A1 CYCLIC COMPOUNDS AND METHODS OF USING SAME SCHRÖDINGER, INC. (US) 2022-09-22 — — WO disclosed
CN-114945571-A Cyclic compounds and methods of use thereof 薛定谔公司 2022-08-26 — — CN disclosed
EP-4021449-A1 STING MODULATORS, COMPOSITIONS, AND METHODS OF USE University of South Florida (US) 2022-07-06 — — EP disclosed
CN-110267960-B Substituted pyrazolo [1,5-a ] pyrazine compounds as RET kinase inhibitors 阿雷生物药品公司 2022-04-26 — — CN disclosed
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