SCHEMBL7301497

SCHEMBL7301497

CCOC(=O)[C@H]1C[C@@H](OS(=O)(=O)c2ccc(C)cc2)CN1C(=O)OCc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.46
TSHR P16473 1/20 0.46
ELANE P08246 1/20 0.45
LMNA P02545 2/20 0.44
ALDH1A1 P00352 2/20 0.44
KMT2A Q03164 1/20 0.44
CA1 P00915 4/20 0.43
CA2 P00918 4/20 0.43
POLB P06746 1/20 0.42
HPGD P15428 1/20 0.40
MMP1 P03956 1/20 0.40
MMP3 P08254 1/20 0.40
MMP7 P09237 1/20 0.40
MMP9 P14780 1/20 0.40
MMP13 P45452 1/20 0.40
MAPT P10636 1/20 0.40
FKBP1A P62942 1/20 0.40
GFER P55789 1/20 0.39
MCL1 Q07820 2/20 0.39

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
SCHEMBL8477959 1.00 GAA (0.46) GAATSHRELANELMNAALDH1A1
SCHEMBL8481025 1.00 GAA (0.46) GAATSHRELANELMNAALDH1A1
SCHEMBL8481733 1.00 GAA (0.46) GAATSHRELANELMNAALDH1A1
SCHEMBL8477961 1.00 GAA (0.46) GAATSHRELANELMNAALDH1A1
SCHEMBL16256989 0.96 ELANE (0.49) GAATSHRELANELMNACA1
SCHEMBL29510702 0.96 ELANE (0.49) GAATSHRELANELMNACA1
SCHEMBL7408543 0.92 ELANE (0.45) GAATSHRELANELMNAALDH1A1
SCHEMBL2569236 0.92 ELANE (0.45) GAATSHRELANELMNAALDH1A1
SCHEMBL2569233 0.92 ELANE (0.45) GAATSHRELANELMNAALDH1A1
SCHEMBL2569312 0.92 ELANE (0.45) GAATSHRELANELMNAALDH1A1

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
US-5942537-A ADMINISTERING A L-TRANS PYRROLIDINE DERIVATIVE TO INHIBIT THE TRANSPORT OF L-GLUTAMATE OR L-ASPARTATE OR AN EXCITATORY AMINO ACID NEUROTRANSMITTER AWAY FROM A SYNAPSE COMPRISING CONTACTING SYNAPSE WITH PYRROLIDINE DERIVATIVE THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1999-08-24 US disclosed
EP-0481756-B1 Benzamide derivatives TEIKOKU CHEM IND CO LTD (JP) 1997-07-09 EP disclosed
US-5143935-A Gastrointestinal disorders TEIKOKU CHEMICAL INDUSTRY CO., LTD. (JP) 1992-09-01 US disclosed
EP-0497895-A1 METHOD OF INHIBITING THE TRANSPORT OF L-GLUTAMATE THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1992-08-12 EP disclosed
EP-0481756-A2 Benzamide derivatives TEIKOKU CHEMICAL INDUSTRY CO., LTD. (JP) 1992-04-22 EP disclosed
WO-1991006536-A1 METHOD OF INHIBITING THE TRANSPORT OF L-GLUTAMATE THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1991-05-16 WO disclosed