SCHEMBL9107630

SCHEMBL9107630

CC(C)CC(C(=O)O)N1C(=O)C(=O)c2c(Cl)cccc21

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BCL2 P10415 5/20 0.44
BCL2L2 Q92843 5/20 0.44
MCL1 Q07820 6/20 0.43
TGM2 P21980 2/20 0.42
TRPA1 O75762 1/20 0.39
AADAT Q8N5Z0 1/20 0.39
KMT2A Q03164 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
SCHEMBL281692 0.88 KMT2A (0.40) TGM2TRPA1AADATKMT2A
SCHEMBL9107280 0.86 SMN1; SMN2 (0.40) TGM2KMT2A
SCHEMBL9109123 0.80 BCL2 (0.49) BCL2BCL2L2MCL1KMT2A
SCHEMBL9105317 0.79 CCKBR (0.39) TGM2TRPA1AADATKMT2A
SCHEMBL9105927 0.78 GCK (0.45) KMT2A
SCHEMBL9105660 0.77 BCL2 (0.42) BCL2BCL2L2MCL1
SCHEMBL9908080 0.77 GCK (0.41)
SCHEMBL9103302 0.77 SMN1; SMN2 (0.41) BCL2BCL2L2MCL1TRPA1AADAT
SCHEMBL9101953 0.77 GCK (0.66) KMT2A
SCHEMBL9908079 0.77 KDM4E (0.44) TGM2KMT2A

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.