SCHEMBL19329863

SCHEMBL19329863

N#Cc1ccc2c(ccn2-c2ccccn2)c1

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CDC7 O00311 9/20 0.64
▸ CDK2 P24941 4/20 0.51
▸ ENPP3 O14638 1/20 0.50
▸ MAP3K14 Q99558 1/20 0.50
▸ GRM5 P41594 6/20 0.47
▸ KDM4E B2RXH2 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ GLA P06280 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ CYP19A1 P11511 1/20 0.43
▸ FFAR4 Q5NUL3 1/20 0.41
▸ METAP2 P50579 1/20 0.39
▸ METAP1 P53582 1/20 0.39

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
SCHEMBL29387648 1.00 CDC7 (0.64) CDC7CDK2ENPP3MAP3K14GRM5
SCHEMBL28562388 0.84 CDC7 (0.60) CDC7CDK2ENPP3MAP3K14KDM4E
SCHEMBL30569112 0.79 IRAK4 (0.44) CDC7GRM5
SCHEMBL23795467 0.78 CDC7 (0.72) CDC7CDK2ENPP3MAP3K14CYP19A1
SCHEMBL18585951 0.78 CDC7 (1.00) CDC7CDK2MAP3K14
SCHEMBL31735499 0.78 MAPT (0.48) CDC7CDK2KDM4EALDH1A1
SCHEMBL20784111 0.78 MAPT (0.48) CDC7CDK2KDM4EALDH1A1
SCHEMBL29388268 0.78 ROCK1 (0.47) CDC7CDK2MAP3K14KDM4EALDH1A1
SCHEMBL23051698 0.78 MAPT (0.48) CDC7CDK2GRM5
SCHEMBL29388217 0.78 MAPT (0.48) CDC7CDK2GRM5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110252351-B Application of copper catalyst in catalyzing reaction of 1-pyridyl indole compound and tert-butyl nitrite 苏州大学 2021-12-10 — — CN claimed
US-10940468-B2 Nickel catalyst, process for preparation and use thereof COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2021-03-09 — — US claimed
WO-2017154022-A1 NOVEL NICKEL CATALYST, PROCESS FOR PREPARATION AND USE THEREOF COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2017-09-14 — — WO claimed
CN-116288422-A Method for realizing 2-position alkylation of indole by utilizing micro-channel photoelectrocatalysis technology and product 南京工业大学 2023-06-23 — — CN disclosed
CN-113214252-B Synthesis method of 6-phenyl-7- (pyridine-2-yl) -7H-indolo [2,3-c ] quinoline compound 常州大学 2022-02-11 — — CN disclosed
CN-110252351-B Application of copper catalyst in catalyzing reaction of 1-pyridyl indole compound and tert-butyl nitrite 苏州大学 2021-12-10 — — CN disclosed
CN-113214252-A Synthesis method of 6-phenyl-7- (pyridine-2-yl) -7H-indolo [2,3-c ] quinoline compound 常州大学 2021-08-06 — — CN disclosed
US-10940468-B2 Nickel catalyst, process for preparation and use thereof COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2021-03-09 — — US disclosed
WO-2017154022-A1 NOVEL NICKEL CATALYST, PROCESS FOR PREPARATION AND USE THEREOF COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2017-09-14 — — 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 (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-10940468-B2 Nickel catalyst, process for preparation and use thereof NISCH, NIT2, C9 CDC7 1430/4885CDK2 2978/4885ENPP3 3889/4885

“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.

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