SCHEMBL8763564

SCHEMBL8763564

O=S(=O)(O)c1ccc(CC2CCCC2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA7 P43166 1/20 0.43
CA9 Q16790 1/20 0.43
CA14 Q9ULX7 1/20 0.43
DUSP3 P51452 1/20 0.42
PTPN5 P54829 1/20 0.42
PTPN11 Q06124 1/20 0.42
LMNA P02545 2/20 0.42
LTA4H P09960 1/20 0.42
TSHR P16473 2/20 0.41
GAA P10253 2/20 0.41
HTT P42858 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HRH3 Q9Y5N1 1/20 0.41
ALDH1A1 P00352 2/20 0.41
NT5E P21589 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
SCHEMBL656154 0.98 KMT2A (0.44) MEN1KMT2ACA12CA1CA2
SCHEMBL2944821 0.95 MEN1 (0.43) MEN1KMT2ACA12CA1CA2
SCHEMBL778057 0.84 CA1 (0.43) MEN1KMT2ACA12CA1CA2
SCHEMBL22123904 0.84 LMNA (0.47) MEN1KMT2ACA12CA1CA2
SCHEMBL20526046 0.83 CYP2D6 (0.50) MEN1KMT2ACA12CA1CA2
SCHEMBL778786 0.82 CA1 (0.37) MEN1KMT2ACA12CA1CA2
SCHEMBL7735405 0.82 DAO (0.41) MEN1KMT2ALMNATSHRALDH1A1
SCHEMBL12453115 0.81 DAO (0.43) MEN1KMT2ACA2LMNAHTT
SCHEMBL9099575 0.80 CDC25B (0.46) MEN1KMT2ACA12CA1CA2
SCHEMBL8788230 0.80 MEN1 (0.43) MEN1KMT2ACA12CA1CA2

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
EP-0635485-B1 TETRAHYDROPHTHALAMIDE DERIVATIVE, INTERMEDIATE FOR PRODUCING THE SAME, PRODUCTION OF BOTH, AND HERBICIDE CONTAINING THE SAME AS ACTIVE INGREDIENT SAGAMI CHEM RES (JP) 1997-06-11 EP disclosed
US-5554581-A Tetrahydrophthalamide derivative, intermediate for producing the same, production of both, and herbicide containing the same as active ingredient SAGAMI CHEMICAL RESEARCH CENTER (JP) 1996-09-10 US disclosed
US-5506190-A Tetrahydrophthalamide derivative, intermediate for producing the same, production of both, and herbicide containing the same as active ingredient SAGAMI CHEMICAL RESEARCH CENTER (JP) 1996-04-09 US disclosed
EP-0635485-A1 TETRAHYDROPHTHALAMIDE DERIVATIVE, INTERMEDIATE FOR PRODUCING THE SAME, PRODUCTION OF BOTH, AND HERBICIDE CONTAINING THE SAME AS ACTIVE INGREDIENT SAGAMI CHEMICAL RESEARCH CENTER (JP) 1995-01-25 EP disclosed