SCHEMBL3093089

SCHEMBL3093089

CCN(CC)C(=O)C(Cc1cccc(NC(=O)c2ccccn2)c1)C(=O)NS(=O)(=O)c1ccc2ccccc2c1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDR P35968 4/20 0.51
NPC1 O15118 3/20 0.45
RAB9A P51151 3/20 0.45
HPGD P15428 1/20 0.45
GAA P10253 3/20 0.45
MAPT P10636 1/20 0.45
HTT P42858 2/20 0.44
PKM P14618 1/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
NPSR1 Q6W5P4 1/20 0.44
LMNA P02545 2/20 0.42
GRM4 Q14833 4/20 0.41
LARS1 Q9P2J5 1/20 0.41
TSHR P16473 1/20 0.41
USP30 Q70CQ3 1/20 0.41
TP53 P04637 1/20 0.41
MAPK1 P28482 1/20 0.41
PTGS2 P35354 1/20 0.40
HDAC6 Q9UBN7 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
SCHEMBL3097370 0.92 NPC1 (0.51) KDRNPC1RAB9AHPGDGAA
Hydrochloric Acid SCHEMBL3101058 0.91 NPC1 (0.50) KDRNPC1RAB9AHPGDGAA
SCHEMBL3085967 0.88 PLG (0.46) NPC1RAB9ASMN1; SMN2LMNALARS1
SCHEMBL3100500 0.85 NPC1 (0.49) KDRNPC1RAB9AHPGDGAA
SCHEMBL3093062 0.85 NPC1 (0.48) KDRNPC1RAB9AHPGDGAA
SCHEMBL3097672 0.84 RAB9A (0.53) NPC1RAB9AHPGDGAAMAPT
SCHEMBL3093128 0.83 FADS1 (0.42) NPC1RAB9ALARS1
SCHEMBL3096740 0.83 LARS1 (0.41) NPC1RAB9AMAPTLMNALARS1
SCHEMBL3079484 0.82 NPC1 (0.46) NPC1RAB9AHPGDMAPTHTT
SCHEMBL15000276 0.82 LARS1 (0.53) HPGDLMNALARS1

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-8461209-B2 Malonic acid sulfonamide derivative and pharmaceutical use thereof MITSUBISHI TANABE PHARMA CORPORATION (JP) 2013-06-11 US disclosed
US-20100228026-A1 NOVEL MALONIC ACID SULFONAMIDE DERIVATIVE AND PHARMACEUTICAL USE THEREOF MITSUBISHI TANABE PHARMA CORPORATION (JP) 2010-09-09 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-20100228026-A1 NOVEL MALONIC ACID SULFONAMIDE DERIVATIVE AND PHARMACEUTICAL USE THEREOF REN, AGTR2, AGTR1 KDR 250/4885NPC1 3306/4885RAB9A 826/4885

“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.