SCHEMBL8376148

SCHEMBL8376148

C[Si](C)(C)CCOCn1cnc2ccc(S(=O)(=O)c3ccccc3)cc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
C1S P09871 1/20 0.40
BRD4 O60885 4/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 1/20 0.36
CREBBP Q92793 1/20 0.35
LMNA P02545 3/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
TP53 P04637 1/20 0.34
MAPT P10636 1/20 0.34
HTT P42858 1/20 0.34
NR1I2 O75469 3/20 0.34
PDE3B Q13370 1/20 0.34
PDE3A Q14432 1/20 0.34
P2RY12 Q9H244 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA7 P43166 1/20 0.34
CA9 Q16790 1/20 0.34

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
SCHEMBL8372860 0.91 NR1I2 (0.41) C1SBRD4NPC1RAB9ACREBBP
SCHEMBL30013328 0.78 SMN1; SMN2 (0.56) NPC1RAB9ALMNASMN1; SMN2MAPT
SCHEMBL2357255 0.78 SMN1; SMN2 (0.56) NPC1RAB9ALMNASMN1; SMN2MAPT
SCHEMBL112610 0.76 DGAT1 (0.40) BRD4NPC1RAB9ACREBBPLMNA
SCHEMBL22900564 0.76 MAPT (0.41) BRD4NPC1RAB9ACREBBPLMNA
SCHEMBL23242636 0.75 MTNR1A (0.36) BRD4NPC1RAB9ACREBBPLMNA
SCHEMBL29224162 0.75 BRD4 (0.38) BRD4NPC1RAB9ACREBBPLMNA
SCHEMBL22524619 0.74 BRD4 (0.36) BRD4NPC1RAB9ACREBBPLMNA
SCHEMBL30040753 0.74 BRD4 (0.39) BRD4CREBBPLMNASMN1; SMN2HTT
SCHEMBL6041792 0.74 BRD4 (0.36) BRD4NPC1CREBBPLMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0625511-B1 Heterocyclic compounds and their use in pharmaceutical ZENECA LTD (GB) 1999-02-17 EP disclosed
US-5504089-A TREATING URINARY INCONTINENCE ZENECA LIMITED (GB) 1996-04-02 US disclosed
EP-0625511-A1 Heterocyclic compounds and their use in pharmaceutical ZENECA LIMITED (GB) 1994-11-23 EP disclosed