SCHEMBL30087866

SCHEMBL30087866

O=C(CBr)Nc1cc(Cl)cc2cc[nH]c12

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ROCK2 O75116 6/20 0.40
▸ POLB P06746 3/20 0.40
▸ MEN1 O00255 3/20 0.40
▸ KMT2A Q03164 3/20 0.40
▸ GRM5 P41594 2/20 0.39
▸ IKBKB O14920 2/20 0.38
▸ CHUK O15111 2/20 0.38
▸ ROCK1 Q13464 2/20 0.38
▸ PKN2 Q16513 2/20 0.38
▸ CDC42 P60953 1/20 0.38
▸ TRPV1 Q8NER1 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.34

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
SCHEMBL28610110 1.00 ROCK2 (0.40) ROCK2POLBMEN1KMT2AGRM5
SCHEMBL30087939 0.80 XDH (0.44) ROCK2GRM5IKBKBCHUK
SCHEMBL28604961 0.80 XDH (0.44) ROCK2GRM5IKBKBCHUK
SCHEMBL21920694 0.78 NR3C1 (0.49) GRM5TRPV1
SCHEMBL30087920 0.78 NR3C1 (0.49) GRM5TRPV1
SCHEMBL30087915 0.77 ALDH1A1 (0.40) MEN1KMT2AKDM4EALDH1A1GAA
SCHEMBL28919719 0.77 ALDH1A1 (0.40) MEN1KMT2AKDM4EALDH1A1GAA
SCHEMBL10634763 0.69 POLB (0.73) POLBMEN1KMT2AGAA
SCHEMBL31384762 0.67 HPGD (0.60) POLBMEN1KMT2AKDM4EALDH1A1
SCHEMBL988532 0.67 KEAP1 (0.56) GRM5IKBKBCHUKALDH1A1SMN1; SMN2

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 2 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

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 ROCK2 2224/4885POLB 3416/4885MEN1 1717/4885
US-20220370420-A1 SPIROCYCLIC 2,3-DIHYDRO-7-AZAINDOLE COMPOUNDS AND USES THEREOF HIPK1, NEK1, HIPK2 ROCK2 2224/4885POLB 3416/4885MEN1 1717/4885

“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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