SCHEMBL23948543

SCHEMBL23948543

COc1cnc(N)c(C)c1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NOS3 P29474 3/20 0.56
NOS1 P29475 3/20 0.56
NOS2 P35228 3/20 0.56
MAP4K4 O95819 2/20 0.42
FGFR1 P11362 2/20 0.39
FYN P06241 6/20 0.39
ALDH1A1 P00352 1/20 0.36
DHFR P00374 2/20 0.36
CHEK2 O96017 1/20 0.36

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
SCHEMBL29492793 1.00 NOS3 (0.56) NOS3NOS1NOS2MAP4K4FGFR1
SCHEMBL2957518 0.80 ALDH1A1 (0.42) NOS3NOS1NOS2MAP4K4FGFR1
SCHEMBL2901554 0.78 FYN (0.45) NOS3NOS1NOS2FYNALDH1A1
SCHEMBL24738147 0.78 HTT (0.56) NOS3NOS1NOS2MAP4K4FGFR1
SCHEMBL7940187 0.77 ALDH1A1 (0.39) NOS3NOS1NOS2ALDH1A1
SCHEMBL28790793 0.77 FYN (0.48) NOS3NOS1NOS2FYNALDH1A1
SCHEMBL12563479 0.77 TAAR1 (0.42) NOS3NOS1NOS2MAP4K4FGFR1
SCHEMBL22207152 0.77 NOS3 (0.39) NOS3NOS1NOS2FGFR1FYN
SCHEMBL13180941 0.77 NOS3 (0.39) NOS3NOS1NOS2MAP4K4FGFR1
SCHEMBL16416335 0.76 NOS3 (0.44) NOS3NOS1NOS2MAP4K4ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110128422-B Synthesis method of 5-methoxy-7-azaindole 金凯(辽宁)生命科技股份有限公司 2022-03-18 CN claimed
CN-110128422-A The synthetic method of 5- methoxyl group -7- azaindole 金凯(辽宁)化工有限公司 2019-08-16 CN claimed
US-20230365559-A1 NOVEL AMINOPYRIDINES AND THEIR USE IN TREATING CANCER AUCKLAND UNISERVICES LIMITED (NZ) 2023-11-16 US disclosed
CN-116669725-A Novel aminopyridine and use thereof in the treatment of cancer 奥克兰联合服务有限公司 2023-08-29 CN disclosed
EP-4217357-A1 NOVEL AMINOPYRIDINES AND THEIR USE IN TREATING CANCER Auckland Uniservices Limited (NZ) 2023-08-02 EP disclosed
EP-4137491-A1 IMIDAZOLINONE DERIVATIVE AND USE THEREOF IN MEDICINE Chengdu Baiyu Pharmaceutical Co., Ltd. (CN) 2023-02-22 EP disclosed
WO-2022064430-A1 NOVEL AMINOPYRIDINES AND THEIR USE IN TREATING CANCER AUCKLAND UNISERVICES LIMITED (NZ) 2022-03-31 WO disclosed
CN-110128422-B Synthesis method of 5-methoxy-7-azaindole 金凯(辽宁)生命科技股份有限公司 2022-03-18 CN disclosed
WO-2021209055-A1 IMIDAZOLINONE DERIVATIVE AND USE THEREOF IN MEDICINE 成都百裕制药股份有限公司 2021-10-21 WO disclosed
CN-110128422-A The synthetic method of 5- methoxyl group -7- azaindole 金凯(辽宁)化工有限公司 2019-08-16 CN 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 (1 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-20230365559-A1 NOVEL AMINOPYRIDINES AND THEIR USE IN TREATING CANCER DCK, DTYMK, TYMP NOS3 2125/4885NOS1 1871/4885NOS2 1395/4885

“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.