SCHEMBL7898010

SCHEMBL7898010

O=C(O)C(c1ccc(O)cc1)S(=O)(=O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 2/20 1.00
LMNA P02545 1/20 0.41
PTPN1 P18031 3/20 0.39
PTPN6 P29350 3/20 0.39
PTPN11 Q06124 3/20 0.39
ESR1 P03372 1/20 0.38
PDCD1 Q15116 1/20 0.38
ESR2 Q92731 1/20 0.38
CD274 Q9NZQ7 1/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA3 P07451 1/20 0.38
TYR P14679 1/20 0.38
DRD1 P21728 1/20 0.38
CA4 P22748 1/20 0.38
CA6 P23280 1/20 0.38
CA5A P35218 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38

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
SCHEMBL6381902 0.98 SRC (0.96) SRCLMNAPTPN1PTPN6PTPN11
SCHEMBL9912818 0.83 SRC (1.00) SRCLMNAPTPN1PTPN6PTPN11
SCHEMBL20869602 0.83 SRC (1.00) SRCLMNAPTPN1PTPN6PTPN11
SCHEMBL11166146 0.83 SRC (1.00) SRCLMNAPTPN1PTPN6PTPN11
SCHEMBL11211519 0.82 SRC (0.69) SRCLMNAPTPN1PTPN6PTPN11
SCHEMBL11147945 0.82 SRC (0.69) SRCLMNAPTPN1PTPN6PTPN11
SCHEMBL11060902 0.82 SRC (0.69) SRCLMNAPTPN1PTPN6PTPN11
SCHEMBL11211513 0.82 SRC (0.69) SRCLMNAPTPN1PTPN6PTPN11
SCHEMBL5016643 0.81 SRC (0.96) SRCLMNAPTPN1PTPN6PTPN11
SCHEMBL28406293 0.81 SRC (0.96) SRCLMNAPTPN1PTPN6PTPN11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6313247-B1 Cinchonan based chiral selectors for separation of stereoisomers LINDNER WOLFGANG (AT) 2001-11-06 US disclosed
US-4244885-A α-Substituted-3-(halomethyl)-4-hydroxybenzeneacetic acids YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 1981-01-13 US disclosed
US-4236002-A ANTIBIOTICS YEDA RESEARCH & DEVELOPMENT CO., LTD. (IL) 1980-11-25 US disclosed
US-4229363-A INTERMEDIATES FOR CEPHALOSPORIN AND PENICILLIN DERIVATIVES YEDA RESEARCH AND DEVELOPMENT CO., LTD. (IL) 1980-10-21 US disclosed
US-4197240-A ANTIBIOTICS YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 1980-04-08 US disclosed