SCHEMBL28998664

SCHEMBL28998664

COc1cc2ncnc(Oc3cccc(NC(=O)Nc4cc(C(C)(CF)C(F)F)on4)c3)c2cc1OC

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRAF P15056 20/20 0.83
RAF1 P04049 10/20 0.79
RIPK2 O43353 1/20 0.77
JAK2 O60674 1/20 0.77
ABL1 P00519 1/20 0.77
EGFR P00533 1/20 0.77
LCK P06239 1/20 0.77
CSF1R P07333 1/20 0.77
LYN P07948 1/20 0.77
RET P07949 1/20 0.77
MET P08581 1/20 0.77
PDGFRB P09619 1/20 0.77
KIT P10721 1/20 0.77
BCR P11274 1/20 0.77
FER P16591 1/20 0.77
FLT1 P17948 1/20 0.77
EPHA2 P29317 1/20 0.77
CYP2C19 P33261 1/20 0.77
KDR P35968 1/20 0.77
MAP2K2 P36507 1/20 0.77

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
SCHEMBL1012327 0.91 BRAF (1.00) BRAFRAF1RIPK2JAK2ABL1
SCHEMBL1012434 0.88 BRAF (1.00) BRAFRAF1RIPK2JAK2ABL1
SCHEMBL1012302 0.88 BRAF (1.00) BRAFRAF1RIPK2JAK2ABL1
SCHEMBL17053430 0.88 BRAF (0.92) BRAFRAF1RIPK2JAK2ABL1
SCHEMBL1012794 0.87 BRAF (0.93) BRAFRAF1RIPK2JAK2ABL1
SCHEMBL1013057 0.87 BRAF (0.93) BRAFRAF1RIPK2JAK2ABL1
Cep-32496 SCHEMBL29351427 0.87 BRAF (1.00) BRAFRAF1RIPK2JAK2ABL1
Cep-32496 SCHEMBL1015932 0.87 BRAF (1.00) BRAFRAF1RIPK2JAK2ABL1
SCHEMBL1012281 0.87 BRAF (1.00) BRAFRAF1RIPK2JAK2ABL1
Cep-32496 SCHEMBL29697285 0.87 BRAF (1.00) BRAFRAF1RIPK2JAK2ABL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
CN-117897159-A Heterocyclic compounds and methods of use 安进公司 2024-04-16 CN disclosed
CN-117881397-A Heterocyclic compounds and methods of use 安进公司 2024-04-12 CN disclosed
CN-117835976-A Heterocyclic compounds and methods of use 安进公司 2024-04-05 CN disclosed
CN-117651700-A 2-aminobenzothiazole compounds and methods of use 安进公司 2024-03-05 CN disclosed
CN-117561063-A Heterocyclic compounds and methods of use 安进公司 2024-02-13 CN 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-116271056-A Cell death inducing agent for cell having BRAF gene mutation, proliferation inhibiting agent for the cell, and pharmaceutical composition for treating disease caused by abnormal proliferation of the cell 日东电工株式会社 2023-06-23 CN disclosed
CN-111630054-B Substituted pyrazolo [3,4-d ] pyrimidine compounds as RET kinase inhibitors 奥瑞生物药品公司 2023-05-09 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