SCHEMBL7296366

SCHEMBL7296366

Clc1cnc(OCCN2CCCC2)c(Cl)c1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 4/20 0.48
TSHR P16473 2/20 0.48
PTGS2 P35354 1/20 0.48
CHRNB2 P17787 1/20 0.47
CHRNA4 P43681 1/20 0.47
HRH3 Q9Y5N1 3/20 0.46
SIGMAR1 Q99720 3/20 0.44
LIPE Q05469 1/20 0.44
KDM4E B2RXH2 1/20 0.44
POLB P06746 1/20 0.44
LMNA P02545 1/20 0.44
CYP2C9 P11712 1/20 0.44
APEX1 P27695 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL7298308 0.98 TSHR (0.50) LTA4HTSHRPTGS2CHRNB2CHRNA4
SCHEMBL7307983 0.88 MEN1 (0.51) LTA4HTSHRHRH3SIGMAR1KDM4E
SCHEMBL7300773 0.87 TSHR (0.57) TSHRSIGMAR1LIPEKDM4E
SCHEMBL8342490 0.87 KDM4E (0.47) LTA4HTSHRCHRNB2CHRNA4SIGMAR1
SCHEMBL11882534 0.74 LMNA (0.53) TSHRLIPEKDM4ELMNACYP2C9
SCHEMBL15673119 0.73 LMNA (0.52) LTA4HTSHRLIPELMNACYP2C9
SCHEMBL22936210 0.73 ALDH1A1 (0.52) TSHRSIGMAR1KDM4E
Hydrochloric Acid SCHEMBL7304834 0.72 KDM4E (0.47) LTA4HTSHRCHRNB2CHRNA4KDM4E
SCHEMBL29987609 0.71 LMNA (0.50) TSHRLIPELMNACYP2C9APEX1
SCHEMBL28617037 0.71 LMNA (0.50) TSHRLIPELMNACYP2C9APEX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0550111-B1 2-Saccharinylmethyl heterocyclic carboxylates useful as proteolytic enzyme inhibitors and pharmaceutical compositions containing them SANOFI SA (FR) 1999-04-14 EP disclosed
US-5856349-A 2-Saccharinylmethyl heterocyclic carboxylates useful as proteolytic enzyme inhibitors and compositions and method of use thereof SANOFI (FR) 1999-01-05 US disclosed
US-5652254-A TREATMENT OF DEGENERATIVE DISEASES, RHEUMATOID ARTHRITIS, PSORIASIS, CYSTIC FIBROSIS SANOFI, S.A. (FR) 1997-07-29 US disclosed
US-5563163-A TREATMENT OF DEGENERATIVE DISEASES STERLING WINTHROP, INC. (US) 1996-10-08 US disclosed
US-5488062-A 2-saccharinylmethyl heterocyclic carboxylates useful as proteolytic enzyme inhibitors and compositions and method of use thereof STERLING WINTHROP INC. (US) 1996-01-30 US disclosed
US-5376653-A A protease enzyme inhibitor for treating degenerative diseases , respiratory system disorders, rheumatoid arthritis and pancreatitis STERLING WINTHROP INC. (US) 1994-12-27 US disclosed
EP-0550111-A1 2-Saccharinylmethyl heterocyclic carboxylates useful as proteolytic enzyme inhibitors and pharmaceutical compositions containing them STERLING WINTHROP INC. (US) 1993-07-07 EP disclosed