SCHEMBL9825968

SCHEMBL9825968

COC(=O)c1sc(C)cc1OC(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 1/20 0.41
MKNK2 Q9HBH9 1/20 0.41
ULK1 O75385 1/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 5/20 0.39
TSHR P16473 1/20 0.39
KMT2A Q03164 1/20 0.39
HSD17B10 Q99714 1/20 0.39
ALDH1A1 P00352 4/20 0.38
HPGD P15428 2/20 0.38
RAF1 P04049 1/20 0.37
XDH P47989 1/20 0.36
NPC1 O15118 3/20 0.36
KDM4E B2RXH2 3/20 0.36
RAB9A P51151 2/20 0.36
CASP3 P42574 1/20 0.36
SENP8 Q96LD8 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
SENP6 Q9GZR1 1/20 0.36
IKBKB O14920 1/20 0.36

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
SCHEMBL21939093 0.83 XDH (0.43) MKNK1MKNK2LMNAKMT2AHSD17B10
SCHEMBL8928555 0.82 MAPT (0.46) MAPTTSHRKMT2AHSD17B10ALDH1A1
SCHEMBL12193329 0.81 XDH (0.34) TSHRALDH1A1XDHICAM1SELE
SCHEMBL12217033 0.76 TSHR (0.34) MKNK1MKNK2LMNAMAPTTSHR
SCHEMBL9826504 0.76 MAPT (0.58) LMNAMAPTKMT2AHSD17B10ALDH1A1
SCHEMBL166726 0.75 MAPT (0.54) MAPTTSHRKMT2AHSD17B10ALDH1A1
SCHEMBL2027674 0.74 MAPT (0.47) LMNAMAPTTSHRKMT2AHSD17B10
SCHEMBL11520628 0.74 MAPT (0.41) LMNAMAPTTSHRKMT2AHSD17B10
Hydrochloric Acid SCHEMBL10735502 0.74 MAPT (0.53) MAPTTSHRKMT2AHSD17B10ALDH1A1
SCHEMBL11886208 0.73 RAF1 (0.43) LMNAMAPTTSHRKMT2AHSD17B10

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-0249236-B1 N-1H-TETRAZOL-5-YL-(5-RING)-CARBOXAMIDE-DERIVATIVES, A PROCESS FOR THEIR MANUFACTURE, AND THE USE THEREOF WARNER-LAMBERT COMPANY (US) 1991-04-24 EP disclosed
US-4824958-A Process for the preparation of n-1H-tetrazol-5-yl-2-pyrrole carboxamides WARNER-LAMBERT COMPANY (US) 1989-04-25 US disclosed
US-4748183-A N-1H-tetrazol-5-yl-2-thiophene carboxamides, N-1H-tetrazol-5-yl-2-pyrrole carboxamides, N-1H-tetrazol-5-yl-2-furan carboxamides, and anti-allergic and anti-inflammatory use thereof WARNER-LAMBERT COMPANY (US) 1988-05-31 US disclosed
EP-0249236-A1 N-1H-Tetrazol-5-yl-(5-Ring)-carboxamide-derivatives, a process for their manufacture, and the use thereof WARNER-LAMBERT COMPANY (US) 1987-12-16 EP disclosed