SCHEMBL7918872

SCHEMBL7918872

CCOC(=O)CN(CCSCc1cc(F)c(OCC(N)=O)c(F)c1)S(=O)(=O)c1ccc(Cl)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.40
TP53 P04637 3/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
NFKB1 P19838 1/20 0.36
PMP22 Q01453 1/20 0.36
HIF1A Q16665 1/20 0.36
HSD17B10 Q99714 1/20 0.36
LMNA P02545 3/20 0.35
CXCR3 P49682 2/20 0.34
ADRB2 P07550 1/20 0.34
THRB P10828 1/20 0.34
TAS2R14 Q9NYV8 1/20 0.34
F10 P00742 1/20 0.34
MAPT P10636 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL7919298 0.89 DAGLA (0.41) ALDH1A1CYP1A2CYP3A4CYP2C9NFKB1
SCHEMBL7918875 0.72 GAA (0.44) ALDH1A1TP53MEN1KMT2ACYP1A2
SCHEMBL7920993 0.70 ALDH1A1 (0.53) ALDH1A1TP53MEN1KMT2ACYP1A2
SCHEMBL22768822 0.69 ALDH1A1 (0.49) ALDH1A1MEN1KMT2ACYP1A2CYP3A4
SCHEMBL16894124 0.65 MMP1 (0.62) ALDH1A1TP53MEN1KMT2ALMNA
SCHEMBL7911552 0.65 ALDH1A1 (0.61) ALDH1A1TP53MEN1KMT2ACYP1A2
SCHEMBL8008261 0.64 ALDH1A1 (0.73) ALDH1A1TP53MEN1KMT2ANPSR1
SCHEMBL2332913 0.64 ADRB2 (0.65) ALDH1A1TP53KMT2AADRB2
SCHEMBL7055916 0.64 ALDH1A1 (0.49) ALDH1A1TP53MEN1KMT2ANPSR1
SCHEMBL7911824 0.64 ALDH1A1 (0.52) ALDH1A1MEN1KMT2ACYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0811375-B1 GLUTAMIC ACID RECEPTOR AGONIST NIPPON SUISAN KAISHA LTD (JP) 2001-01-03 EP disclosed
US-5955505-A TREATING NERVE DEGENERATIVE DISORDERS NIPPON SUISAN KAISHA, LTD. (JP) 1999-09-21 US disclosed
EP-0811375-A1 GLUTAMIC ACID RECEPTOR AGONIST NIPPON SUISAN KAISHA, LTD. (JP) 1997-12-10 EP disclosed
EP-0469901-B1 Sulfonamide derivatives TAISHO PHARMACEUTICAL CO LTD (JP) 1994-10-19 EP disclosed
US-5189211-A Thromboxane A2 antagonists TAISHO PHARMACEUTICAL CO., LTD. (JP) 1993-02-23 US disclosed
EP-0469901-A1 Sulfonamide derivatives TAISHO PHARMACEUTICAL CO. LTD (JP) 1992-02-05 EP disclosed