SCHEMBL6984974

SCHEMBL6984974

COC(=O)c1cccc(OC(=O)CN)c1C(=O)OC(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 1/20 0.40
ALDH1A1 P00352 3/20 0.38
HSD17B10 Q99714 2/20 0.38
CFTR P13569 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA5A P35218 1/20 0.38
CA9 Q16790 1/20 0.38
EPHX2 P34913 1/20 0.36
HTT P42858 1/20 0.36
KMT2A Q03164 1/20 0.36
KDM4E B2RXH2 2/20 0.36
PRSS1 P07477 1/20 0.36
ACR P10323 1/20 0.36
SLC7A5 Q01650 1/20 0.36
LMNA P02545 1/20 0.36
TSHR P16473 1/20 0.36
HPGD P15428 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
SCHEMBL6981189 0.82 SLC7A5 (0.37) ALDH1A1CA1CA2CA9EPHX2
SCHEMBL6984597 0.82 KMT2A (0.42) ALDH1A1EPHX2KMT2AKDM4ESLC7A5
SCHEMBL6723581 0.81 ELANE (0.44) SLC6A3ALDH1A1HSD17B10HTTKMT2A
SCHEMBL6985192 0.81 KMT2A (0.42) ALDH1A1HSD17B10KMT2AKDM4ESLC7A5
SCHEMBL6984283 0.80 SLC7A5 (0.38) ALDH1A1EPHX2KMT2AKDM4ESLC7A5
SCHEMBL6981261 0.79 SLC7A5 (0.37) EPHX2KMT2AKDM4ESLC7A5TSHR
SCHEMBL6582605 0.79 SLC7A5 (0.37) CA1CA2CA9EPHX2KMT2A
SCHEMBL6984281 0.79 SMN1; SMN2 (0.36) ALDH1A1EPHX2KDM4ESLC7A5TSHR
SCHEMBL6977356 0.77 MRGPRX1 (0.35) ALDH1A1HSD17B10EPHX2KDM4ESLC7A5
SCHEMBL6988917 0.77 SLC7A5 (0.36) EPHX2KMT2AKDM4ESLC7A5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1289972-A1 SERINE PROTEASE INHIBITORS ELI LILLY AND COMPANY (US) 2003-03-12 EP disclosed
EP-1289953-A1 SERINE PROTEASE INHIBITORS ELI LILLY AND COMPANY (US) 2003-03-12 EP disclosed
EP-1289954-A1 SERINE PROTEASE INHIBITORS ELI LILLY AND COMPANY (US) 2003-03-12 EP disclosed
EP-1289950-A1 SERINE PROTEASE INHIBITORS ELI LILLY AND COMPANY (US) 2003-03-12 EP disclosed
WO-2001096304-A1 SERINE PROTEASE INHIBITORS ELI LILLY AND COMPANY (US) 2001-12-20 WO disclosed
WO-2001096323-A1 SERINE PROTEASE INHIBITORS ELI LILLY AND COMPANY (US) 2001-12-20 WO disclosed
WO-2001096303-A1 SERINE PROTEASE INHIBITORS ELI LILLY AND COMPANY (US) 2001-12-20 WO disclosed
WO-2001096296-A1 SERINE PROTEASE INHIBITORS ELI LILLY AND COMPANY (US) 2001-12-20 WO disclosed