SCHEMBL4838548

SCHEMBL4838548

COc1ccc(C)cc1-c1ccc(S(=O)(=O)N2c3ccccc3C[C@H]2C(=O)NCc2ccc(C(=O)O)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.42
LMNA P02545 5/20 0.42
RAB9A P51151 2/20 0.41
TP53 P04637 1/20 0.40
SCN9A Q15858 1/20 0.40
MAPT P10636 1/20 0.40
HTT P42858 1/20 0.39
OXTR P30559 1/20 0.39
AVPR1A P37288 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
SCHEMBL4843262 0.91 RAB9A (0.43) LMNARAB9AMAPT
SCHEMBL4842506 0.90 TRPA1 (0.41) ALDH1A1SMN1; SMN2LMNAMAPT
SCHEMBL4840487 0.89 RAB9A (0.42) LMNARAB9ATP53MAPT
SCHEMBL4838603 0.89 RAB9A (0.44) LMNARAB9AMAPT
SCHEMBL4832807 0.86 MAPT (0.44) LMNARAB9AMAPT
SCHEMBL4834080 0.83 POLB (0.41) ALDH1A1LMNATP53MAPT
SCHEMBL4844332 0.81 MEN1 (0.40) LMNAMAPT
SCHEMBL4841229 0.81 POLB (0.41) ALDH1A1LMNATP53MAPT
SCHEMBL4833457 0.81 MMP8 (0.40) LMNAMAPT
SCHEMBL4841170 0.81 TRPA1 (0.44) LMNAMAPT

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-7465811-B2 Indoline compounds LABORATOIRES FOURNIER S.A. (FR) 2008-12-16 US disclosed
US-20080119465-A1 Novel Indoline Compounds LABORATORIES FOURNIER S.A. (FR) 2008-05-22 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-20080119465-A1 Novel Indoline Compounds GPR119, INSR, IRS1 ALDH1A1 1819/4885SMN1; SMN2 2595/4885LMNA 1943/4885

“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.