SCHEMBL23834593

SCHEMBL23834593

O=C1Nc2cc(N3CCCCC3)c(F)cc2C1=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CASP3 P42574 4/20 0.44
▸ IP6K1 Q92551 1/20 0.43
▸ CASP1 P29466 1/20 0.42
▸ CASP7 P55210 1/20 0.42
▸ CASP9 P55211 1/20 0.42
▸ CES1 P23141 2/20 0.42
▸ MAPT P10636 4/20 0.42
▸ ALDH1A1 P00352 3/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ MAPK1 P28482 1/20 0.41
▸ TSHR P16473 1/20 0.40
▸ LRRK2 Q5S007 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ PKM P14618 1/20 0.39
▸ TGM2 P21980 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ CYP2C9 P11712 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
SCHEMBL4585247 0.87 CRBN (0.49) CES1MAPTALDH1A1SMN1; SMN2LMNA
SCHEMBL4585213 0.78 ALDH1A1 (0.39) CES1MAPTALDH1A1LMNA
SCHEMBL1589486 0.75 CES1 (0.57) CASP3CES1MAPTALDH1A1TGM2
SCHEMBL29758482 0.75 CES1 (0.57) CASP3CES1MAPTALDH1A1TGM2
SCHEMBL9885117 0.73 MAPT (0.40) MAPTALDH1A1LMNA
SCHEMBL12689505 0.72 CASP3 (0.32) CASP3CASP1CASP7CASP9CES1
SCHEMBL1854671 0.71 ALDH1A1 (0.43) IP6K1CASP1CASP7MAPTALDH1A1
SCHEMBL6283250 0.71 CASP3 (0.57) CASP3CASP1CASP7CASP9CES1
SCHEMBL22909290 0.69 MAPK1 (0.50) IP6K1MAPTALDH1A1SMN1; SMN2MAPK1
SCHEMBL1085000 0.69 CES1 (0.58) CES1ALDH1A1TGM2

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-20230132973-A1 DIHYDRO-SPIRO[INDOLINE-3:1'-iSOQUINOLIN]-2-ONES AS ANTIMALARIAL AGENTS THE UNIV OF BUEA (CM) 2023-05-04 — — US disclosed
WO-2021186348-A1 DIHYDRO-SPIRO[INDOLINE-3:1'-ISOQUINOLIN]-2-ONES AS ANTIMALARIAL AGENTS THE UNIVERSITY OF BUEA (CM) 2021-09-23 — — 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-20230132973-A1 DIHYDRO-SPIRO[INDOLINE-3:1'-iSOQUINOLIN]-2-ONES AS ANTIMALARIAL AGENTS QDPR, NQO1, IDO2 CASP3 278/4885IP6K1 276/4885CASP1 797/4885

“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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