SCHEMBL6812384

SCHEMBL6812384

C/C=C/CNCC(=O)OC

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.44
RECQL P46063 1/20 0.42
TET2 Q6N021 1/20 0.39
LMNA P02545 3/20 0.38
ALDH1A1 P00352 2/20 0.38
HSD17B10 Q99714 2/20 0.36
MGAM O43451 1/20 0.36
GAA P10253 1/20 0.36
SI P14410 1/20 0.36
MGAM2 Q2M2H8 1/20 0.36
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
CA12 O43570 1/20 0.33
CA14 Q9ULX7 1/20 0.33
KDM4E B2RXH2 1/20 0.33
EPHX2 P34913 1/20 0.33
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
CTSK P43235 2/20 0.32

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
SCHEMBL6812393 1.00 TSHR (0.44) TSHRRECQLTET2LMNAALDH1A1
SCHEMBL7472994 0.82 GAA (0.46) TSHRALDH1A1HSD17B10MGAMGAA
SCHEMBL7472998 0.82 GAA (0.46) TSHRALDH1A1HSD17B10MGAMGAA
SCHEMBL22646405 0.82 GAA (0.46) TSHRALDH1A1HSD17B10MGAMGAA
SCHEMBL18798176 0.80 CTSK (0.45) CA12CA14MAPTCTSK
SCHEMBL10040671 0.79
SCHEMBL455193 0.77
SCHEMBL866509 0.77
SCHEMBL232854 0.77
SCHEMBL20009464 0.76 MGAM (0.35) TSHRRECQLTET2LMNAALDH1A1

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-0951471-B1 CYCLOALKYL INHIBITORS OF PROTEIN FARNESYLTRANSFERASE WARNER LAMBERT CO (US) 2004-03-17 EP disclosed
EP-1076663-B1 FUNCTIONALIZED ALKYL AND ALKENYL SIDE CHAIN DERIVATIVES OF GLYCINAMIDES AS FARNESYL TRANSFERASE INHIBITORS WARNER LAMBERT CO (US) 2004-02-18 EP disclosed
US-6369034-B1 FOR THERAPY OF CANCER, RESTENOSIS, AND ATHEROSCLEROSIS WARNER-LAMBERT COMPANY 2002-04-09 US disclosed
US-6281194-B1 E.G., (S)-(1-((4-BENZYLOXY-BENZYL)-(((1-PHENYL-CYCLOBUTYLMETHYL)-CAR BAMOYL)-METHYL)-CARBAMOYL)-2-(1H-IMIDAZOL-4-YL)-ETHYL)-CARBAMI C ACID BENZYL ESTER WARNER-LAMBERT COMPANY 2001-08-28 US disclosed
EP-1076663-A1 FUNCTIONALIZED ALKYL AND ALKENYL SIDE CHAIN DERIVATIVES OF GLYCINAMIDES AS FARNESYL TRANSFERASE INHIBITORS WARNER-LAMBERT COMPANY (US) 2001-02-21 EP disclosed
WO-1999055725-A1 FUNCTIONALIZED ALKYL AND ALKENYL SIDE CHAIN DERIVATIVES OF GLYCINAMIDES AS FARNESYL TRANSFERASE INHIBITORS WARNER-LAMBERT COMPANY (US) 1999-11-04 WO disclosed
EP-0951471-A1 CYCLOALKYL INHIBITORS OF PROTEIN FARNESYLTRANSFERASE WARNER-LAMBERT COMPANY (US) 1999-10-27 EP disclosed
WO-1998027109-A1 CYCLOALKYL INHIBITORS OF PROTEIN FARNESYLTRANSFERASE WARNER-LAMBERT COMPANY (US) 1998-06-25 WO disclosed