SCHEMBL8610607

SCHEMBL8610607

C[C@H](CC(=O)ON1C(=O)CCC1=O)SSc1ccccn1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.38
EHMT2 Q96KQ7 1/20 0.36
EHMT1 Q9H9B1 1/20 0.36
APOBEC3G Q9HC16 1/20 0.36
HPGD P15428 4/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
TSHR P16473 1/20 0.35
SMN1; SMN2 Q16637 6/20 0.34
HSD17B10 Q99714 3/20 0.34
ALDH1A1 P00352 5/20 0.34
RAB9A P51151 4/20 0.34
NPC1 O15118 2/20 0.34
MAPT P10636 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
KDM4E B2RXH2 1/20 0.33
ALOX15 P16050 1/20 0.33
GRM2 Q14416 1/20 0.32
POLB P06746 1/20 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
SCHEMBL321113 1.00 LMNA (0.38) LMNAEHMT2EHMT1APOBEC3GHPGD
SCHEMBL29351145 1.00 LMNA (0.38) LMNAEHMT2EHMT1APOBEC3GHPGD
SCHEMBL109627 0.89 LMNA (0.37) LMNAEHMT2EHMT1APOBEC3GHPGD
SCHEMBL20384698 0.89 LMNA (0.37) LMNAEHMT2EHMT1APOBEC3GHPGD
SCHEMBL29398201 0.89 LMNA (0.37) LMNAEHMT2EHMT1APOBEC3GHPGD
SCHEMBL23086185 0.88 SMN1; SMN2 (0.41) LMNAHPGDMEN1KMT2ATSHR
Hydrochloric Acid SCHEMBL30767122 0.88 LMNA (0.36) LMNAEHMT2EHMT1APOBEC3GHPGD
SCHEMBL11367709 0.87 LMNA (0.39) LMNAEHMT2EHMT1APOBEC3GHPGD
SCHEMBL22415048 0.85 ALDH1A1 (0.35) LMNAEHMT2EHMT1APOBEC3GHPGD
SCHEMBL10340552 0.85 LMNA (0.34) LMNAEHMT2EHMT1APOBEC3GHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0528527-B1 Conjugates ZENECA LTD (GB) 1998-04-08 EP disclosed
EP-0528527-A2 Conjugates ZENECA LIMITED (GB) 1993-02-24 EP disclosed