SCHEMBL9107551

SCHEMBL9107551

COC(=O)C(CC1CCCC1)N1C(=O)C(=O)c2ccc(SC)cc21

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.36
ALDH1A1 P00352 2/20 0.35
HPGD P15428 2/20 0.35
GCK P35557 9/20 0.35
REN P00797 2/20 0.34
CASP6 P55212 1/20 0.34
GAA P10253 1/20 0.33
USP19 O94966 1/20 0.33
PKM P14618 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
POLB P06746 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL9105121 0.89 GCK (0.35) HPGDGCKUSP19SMN1; SMN2
SCHEMBL9107847 0.86 GCK (0.40) ALDH1A1GCKRENUSP19
SCHEMBL9108781 0.85 F11 (0.38) RAB9AGCKREN
SCHEMBL9106688 0.85 GCK (0.36) ALDH1A1GCKRENGAAUSP19
SCHEMBL9105799 0.85 GCK (0.36) ALDH1A1GCKRENGAAUSP19
SCHEMBL9109747 0.83 ALDH1A1 (0.46) RAB9AALDH1A1GCKRENGAA
SCHEMBL9105979 0.80 ALDH1A1 (0.44) ALDH1A1GCKSMN1; SMN2POLBKMT2A
SCHEMBL9105493 0.79 PARK7 (0.39) RAB9AALDH1A1GCKGAASMN1; SMN2
SCHEMBL9102207 0.79 F11 (0.40) ALDH1A1GCK
SCHEMBL9107290 0.79 CUL4A (0.43) ALDH1A1GCKUSP19

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 1 patent. 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 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 RAB9A 1778/4885ALDH1A1 646/4885HPGD 791/4885

“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.