SCHEMBL3528151

SCHEMBL3528151

COC(=O)CCCC#Cc1cc(Cl)ccc1NS(=O)(=O)c1cccc2cccnc12

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.56
MEN1 O00255 5/20 0.56
ATM Q13315 1/20 0.49
SLC16A3 O15427 3/20 0.48
SLC16A7 O60669 1/20 0.48
SLC16A8 O95907 1/20 0.48
HTR5A P47898 1/20 0.48
SLC40A1 Q9NP59 4/20 0.46
ALDH1A1 P00352 2/20 0.46
POLB P06746 2/20 0.46
TSHR P16473 1/20 0.46
GAA P10253 1/20 0.44
FABP1 P07148 1/20 0.43

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
SCHEMBL3524543 0.95 KMT2A (0.58) KMT2AMEN1ATMSLC16A3SLC16A7
SCHEMBL3523363 0.86 SLC16A3 (0.43) KMT2AMEN1SLC16A3SLC16A7SLC16A8
SCHEMBL3526360 0.84 PTGES2 (0.48) SLC16A3SLC16A7SLC16A8HTR5A
SCHEMBL3524588 0.84 CCKBR (0.51) POLB
SCHEMBL3525579 0.81 CCKBR (0.42) KMT2AMEN1SLC16A3SLC16A7SLC16A8
SCHEMBL3519735 0.81 SLC16A3 (0.45) KMT2AMEN1SLC16A3SLC16A7SLC16A8
SCHEMBL3528825 0.80 ALDH1A1 (0.56) KMT2AMEN1SLC16A3ALDH1A1
SCHEMBL3526026 0.78 PTGES2 (0.50)
SCHEMBL3527759 0.78 SLC16A3 (0.48) KMT2AMEN1SLC16A3SLC40A1ALDH1A1
SCHEMBL3520453 0.77 ERBB2 (0.47) KMT2AMEN1ATMALDH1A1GAA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8436040-B2 Method of treating conditions involving PPAR-receptors with indole compounds LABORATOIRES FOURNIER S.A. (FR) 2013-05-07 US disclosed
US-20100286137-A1 Method of Treating Conditions Involving PPAR-Receptors with Indole Compounds LABORATORIES FOURNIER S.A. (FR) 2010-11-11 US disclosed
US-7795297-B2 Indole compounds, method of preparing them and uses thereof LABORATORIES FOURNIER S.A. (FR) 2010-09-14 US disclosed
US-20080153816-A1 Indole Compounds, Method of Preparing Them and Uses Thereof LABORATOIRES FOURNIER S.A. (FR) 2008-06-26 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 (2 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-20080153816-A1 Indole Compounds, Method of Preparing Them and Uses Thereof LIPG, GPR119, IAPP KMT2A 2305/4885MEN1 2711/4885ATM 634/4885
US-20100286137-A1 Method of Treating Conditions Involving PPAR-Receptors with Indole Compounds GPR119, PPARA, PPARG KMT2A 2990/4885MEN1 4787/4885ATM 1050/4885

“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.