SCHEMBL3090637

SCHEMBL3090637

CCN(CC)C(=O)C(Cc1ccc(NC(=O)c2ccc(F)cc2)cc1)C(=O)NS(=O)(=O)c1ccc2ccccc2c1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.48
ENPP3 O14638 1/20 0.48
ENPP1 P22413 1/20 0.48
MEN1 O00255 5/20 0.45
KMT2A Q03164 5/20 0.45
MAPT P10636 2/20 0.45
LMNA P02545 2/20 0.45
KDM4E B2RXH2 1/20 0.45
ALDH1A1 P00352 1/20 0.45
USP30 Q70CQ3 6/20 0.44
GPR27 Q9NS67 1/20 0.43
LARS1 Q9P2J5 1/20 0.42
BCHE P06276 1/20 0.42
RXFP1 Q9HBX9 1/20 0.41

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
SCHEMBL3093901 0.93 MMP9 (0.46) RAB9AMEN1KMT2ALMNAALDH1A1
SCHEMBL3102970 0.93 MMP9 (0.46) RAB9AMEN1KMT2ALMNAALDH1A1
SCHEMBL3092998 0.92 NPC1 (0.51) RAB9AENPP1MEN1KMT2AMAPT
SCHEMBL3090792 0.92 NPC1 (0.51) RAB9AENPP1MEN1KMT2AMAPT
SCHEMBL3085893 0.92 NPC1 (0.52) RAB9AENPP3ENPP1MEN1KMT2A
SCHEMBL3096373 0.92 NPC1 (0.52) RAB9AENPP3ENPP1MEN1KMT2A
SCHEMBL3090974 0.92 MEN1 (0.50) RAB9AENPP3ENPP1MEN1KMT2A
SCHEMBL3093732 0.92 LARS1 (0.44) RAB9AMEN1KMT2ALMNAALDH1A1
SCHEMBL15000123 0.91 LARS1 (0.49) MEN1KMT2ALARS1
SCHEMBL3100199 0.91 NPC1 (0.53) RAB9AMEN1KMT2AMAPTLMNA

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 RAB9A 826/4885ENPP3 1838/4885ENPP1 1890/4885

“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.