SCHEMBL2099404

SCHEMBL2099404

CCC(CC)(N(c1c(-c2nc3ccccc3o2)ccc2ccccc12)S(=O)(=O)c1cc(Cl)cc(Cl)c1)P(=O)(O)O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 3/20 0.37
PTPN2 P17706 4/20 0.36
PTPN1 P18031 4/20 0.36
HSPD1 P10809 3/20 0.36
HSPE1 P61604 3/20 0.36
MAPT P10636 7/20 0.35
KDM4E B2RXH2 3/20 0.35
ALDH1A1 P00352 3/20 0.35
HPGD P15428 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
NPC1 O15118 1/20 0.35
TP53 P04637 1/20 0.35
GLA P06280 1/20 0.35
GAA P10253 1/20 0.35
PKM P14618 1/20 0.35
CASP1 P29466 1/20 0.35
RAB9A P51151 1/20 0.35
CASP7 P55210 1/20 0.35
HSD17B10 Q99714 1/20 0.35
USP2 O75604 1/20 0.35

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
SCHEMBL2055505 0.82 HSPD1 (0.39) PTGS2PTPN2PTPN1HSPD1HSPE1
SCHEMBL2098308 0.82 RXFP1 (0.37) MAPTKDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL2098604 0.81 ACP3 (0.33) MAPTALDH1A1TP53GAAHSD17B10
SCHEMBL2098040 0.81 BDKRB1 (0.32) MAPTTP53
SCHEMBL2098705 0.81 CYP1A2 (0.33) MAPTKDM4EALDH1A1TP53USP2
SCHEMBL2055436 0.80 PTPN2 (0.44) PTGS2PTPN2PTPN1HSPD1HSPE1
SCHEMBL2098828 0.80 ACP3 (0.32) PTPN1
SCHEMBL2055397 0.79 UTRN (0.37) PTGS2PTPN2PTPN1HSPD1HSPE1
SCHEMBL2098368 0.78 PDE4D (0.36) MAPTALDH1A1SMN1; SMN2RAB9A
SCHEMBL2098823 0.78 ITGA4 (0.31)

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-8163911-B2 Arylsulfonylaminomethylphosphonic acid derivatives, the preparation thereof and the use thereof as pharmaceutical compositions BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-04-24 US disclosed
US-20100261677-A1 ARYLSULFONYLAMINOMETHYLPHOSPHONIC ACID DERIVATIVES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-10-14 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-20100261677-A1 ARYLSULFONYLAMINOMETHYLPHOSPHONIC ACID DERIVATIVES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS ARSA, SULT2A1, PMM2 PTGS2 1540/4885PTPN2 75/4885PTPN1 20/4885

“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.