SCHEMBL21921447

SCHEMBL21921447

COC(=O)[C@H]1CC[C@@]2(CC1)CNc1ncc(Br)c(Cl)c12

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MAP4K1 Q92918 15/20 0.40
▸ CYP3A4 P08684 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ PDCD1 Q15116 1/20 0.32
▸ CD274 Q9NZQ7 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ LMNA P02545 1/20 0.32

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
SCHEMBL28603251 1.00 MAP4K1 (0.40) MAP4K1CYP3A4KDM4ESMN1; SMN2MEN1
SCHEMBL30087777 1.00 MAP4K1 (0.40) MAP4K1CYP3A4KDM4ESMN1; SMN2MEN1
SCHEMBL21920556 0.93 MAP4K1 (0.45) MAP4K1CYP3A4KDM4ESMN1; SMN2MEN1
SCHEMBL21919955 0.86 MAP4K1 (0.40) MAP4K1CYP3A4KDM4E
SCHEMBL21920324 0.85 MAP4K1 (0.48) MAP4K1CYP3A4
SCHEMBL30087805 0.85 MAP4K1 (0.48) MAP4K1CYP3A4
SCHEMBL30087806 0.85 MAP4K1 (0.48) MAP4K1CYP3A4
SCHEMBL21920327 0.85 MAP4K1 (0.48) MAP4K1CYP3A4
SCHEMBL21920330 0.84 MAP4K1 (0.42) MAP4K1CYP3A4
SCHEMBL30087751 0.84 MAP4K1 (0.42) MAP4K1CYP3A4

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 3 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
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 MAP4K1 36/4885CYP3A4 3696/4885KDM4E 2498/4885
US-20220370420-A1 SPIROCYCLIC 2,3-DIHYDRO-7-AZAINDOLE COMPOUNDS AND USES THEREOF HIPK1, NEK1, HIPK2 MAP4K1 36/4885CYP3A4 3696/4885KDM4E 2498/4885

“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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