SCHEMBL3501853

SCHEMBL3501853

CCC(C(=O)O)C1CN=C(c2cc3cccc(NS(=O)(=O)c4ccccn4)c3[nH]2)S1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 3/20 0.40
GLO1 Q04760 4/20 0.39
SLC40A1 Q9NP59 4/20 0.39
METAP2 P50579 1/20 0.38
TUBB4A P04350 1/20 0.37
TUBB P07437 1/20 0.37
TUBA3C P0DPH7 1/20 0.37
TUBA1B P68363 1/20 0.37
TUBA4A P68366 1/20 0.37
TUBB4B P68371 1/20 0.37
TUBB3 Q13509 1/20 0.37
TUBB2A Q13885 1/20 0.37
TUBB8 Q3ZCM7 1/20 0.37
TUBA3E Q6PEY2 1/20 0.37
TUBA1A Q71U36 1/20 0.37
TUBA1C Q9BQE3 1/20 0.37
TUBB6 Q9BUF5 1/20 0.37
TUBB2B Q9BVA1 1/20 0.37
TUBB1 Q9H4B7 1/20 0.37
KCNA5 P22460 3/20 0.36

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
SCHEMBL3501607 0.85 LMNA (0.31)
SCHEMBL3499992 0.85 NFKBIA (0.38) MMP2GLO1TUBB4ATUBBTUBA3C
SCHEMBL2966007 0.85 GLO1 (0.41) MMP2GLO1SLC40A1TUBB4ATUBB
SCHEMBL2660220 0.83 MMP2 (0.43) MMP2GLO1SLC40A1METAP2TUBB4A
SCHEMBL2661075 0.81 GLO1 (0.41) MMP2GLO1SLC40A1METAP2TUBB4A
SCHEMBL2660222 0.81 SLC40A1 (0.41) MMP2GLO1SLC40A1METAP2TUBB4A
SCHEMBL2660982 0.81 SLC40A1 (0.38) MMP2GLO1SLC40A1TUBB4ATUBB
SCHEMBL9073038 0.81 SLC40A1 (0.38) MMP2GLO1SLC40A1METAP2TUBB4A
SCHEMBL3499013 0.76 PPARG (0.31)
SCHEMBL2660735 0.75 GLO1 (0.38) MMP2GLO1SLC40A1METAP2TUBB4A

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-8410087-B2 Indole compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-04-02 US disclosed
US-20100144702-A1 INDOLE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-06-10 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-20100144702-A1 INDOLE COMPOUND GCKR, GPR119, SLC5A1 MMP2 175/4885GLO1 91/4885SLC40A1 1246/4885

“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.