SCHEMBL9105660

SCHEMBL9105660

CC(C)CC(C(=O)O)N1C(=O)C(=O)c2ccc(Cl)cc21

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BCL2 P10415 5/20 0.42
BCL2L2 Q92843 5/20 0.42
MCL1 Q07820 7/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
APAF1 O14727 1/20 0.41
ALDH1A1 P00352 2/20 0.39
ALDH2 P05091 1/20 0.38
ALDH3A1 P30838 1/20 0.38

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
SCHEMBL9105740 0.91 ALDH1A1 (0.46) BCL2BCL2L2MCL1SMN1; SMN2ALDH1A1
SCHEMBL9104273 0.87 NPSR1 (0.43) MCL1SMN1; SMN2APAF1ALDH1A1
SCHEMBL9109123 0.83 BCL2 (0.49) BCL2BCL2L2MCL1ALDH1A1
SCHEMBL21851967 0.82 ALDH1A1 (0.50) BCL2BCL2L2SMN1; SMN2ALDH1A1
SCHEMBL9108726 0.79 NPSR1 (0.42) SMN1; SMN2ALDH1A1ALDH2ALDH3A1
SCHEMBL9108548 0.79 GRN (0.39) APAF1
SCHEMBL9108016 0.78 ALDH1A1 (0.53) BCL2BCL2L2MCL1SMN1; SMN2ALDH1A1
SCHEMBL9107804 0.78 FFAR2 (0.48) SMN1; SMN2ALDH1A1
SCHEMBL9104263 0.78 FFAR2 (0.47) SMN1; SMN2ALDH1A1
SCHEMBL9908115 0.78 FFAR2 (0.48) SMN1; SMN2ALDH1A1

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-20120142705-A1 ISATIN AND OXINDOLE COMPOUNDS KESTER ROBERT FRANCIS (US) 2012-06-07 US claimed
US-20120142705-A1 ISATIN AND OXINDOLE COMPOUNDS KESTER ROBERT FRANCIS (US) 2012-06-07 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 (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-20120142705-A1 ISATIN AND OXINDOLE COMPOUNDS GPR119, INSR, OAT BCL2 740/4885BCL2L2 535/4885MCL1 3695/4885

“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.