SCHEMBL21921428

SCHEMBL21921428

CC(=O)N(C)c1cc(C#N)cc2ccn(C)c12

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ XDH P47989 1/20 0.37
▸ FSCN1 Q16658 1/20 0.34
▸ CCNE2 O96020 1/20 0.33
▸ CDK4 P11802 1/20 0.33
▸ CCND1 P24385 1/20 0.33
▸ CCNE1 P24864 1/20 0.33
▸ CDK2 P24941 1/20 0.33
▸ ITK Q08881 1/20 0.32
▸ PGR P06401 1/20 0.32
▸ TSPO P30536 1/20 0.32
▸ NCEH1 Q6PIU2 2/20 0.31
▸ GPR35 Q9HC97 1/20 0.31
▸ EGLN2 Q96KS0 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ TDP1 Q9NUW8 1/20 0.30
▸ CHRNA7 P36544 1/20 0.30
▸ CACNA1H O95180 1/20 0.30

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
SCHEMBL28595643 0.78 BRPF1 (0.34) XDHCCNE2CDK4CCND1CCNE1
SCHEMBL28600207 0.77 DYRK1A (0.39) XDHPGRGPR35EGLN2MAPT
SCHEMBL30087761 0.77 DYRK1A (0.39) XDHPGRGPR35EGLN2MAPT
SCHEMBL16571759 0.64 CYP11B1 (0.38) XDH
SCHEMBL25159963 0.63 PGR (0.39) FSCN1ITKPGRNCEH1GPR35
SCHEMBL30790881 0.63 XDH (0.56) XDH
SCHEMBL7873808 0.62 PGR (0.61) PGRMAPT
SCHEMBL1779268 0.61 PRKCI (0.53) CHRNA7CACNA1H
SCHEMBL29499059 0.61 PRKCI (0.53) CHRNA7CACNA1H
SCHEMBL23609756 0.61 CYP11B1 (0.39) FSCN1PGRNCEH1EGLN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12208088-B2 Spirocyclic 2,3-dihydro-7-azaindole compounds and uses thereof GENENTECH, INC. (US) 2025-01-28 — — US disclosed
US-20220370420-A1 SPIROCYCLIC 2,3-DIHYDRO-7-AZAINDOLE COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2022-11-24 — — US disclosed
CN-113015526-A Spirocyclic 2, 3-dihydro-7-azaindole compounds and uses thereof 豪夫迈·罗氏有限公司 2021-06-22 — — CN disclosed
WO-2020061377-A1 SPIROCYCLIC 2,3-DIHYDRO-7-AZAINDOLE COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2020-03-26 — — 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 (2 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-12208088-B2 Spirocyclic 2,3-dihydro-7-azaindole compounds and uses thereof HIPK1, NEK1, HIPK2 XDH 2184/4885FSCN1 4634/4885CCNE2 2871/4885
US-20220370420-A1 SPIROCYCLIC 2,3-DIHYDRO-7-AZAINDOLE COMPOUNDS AND USES THEREOF HIPK1, NEK1, HIPK2 XDH 2184/4885FSCN1 4634/4885CCNE2 2871/4885

“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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