SCHEMBL8410463

SCHEMBL8410463

C=C(c1ccc(C)c(C)c1)c1ccc(C)c(C)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 1/20 0.54
PRSS2 P07478 1/20 0.54
PRSS3 P35030 1/20 0.54
HTT P42858 2/20 0.48
CES2 O00748 1/20 0.48
CES1 P23141 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
ALDH1A1 P00352 5/20 0.42
NPC1 O15118 2/20 0.42
MITF O75030 1/20 0.42
LMNA P02545 1/20 0.42
POLB P06746 1/20 0.42
MAPT P10636 3/20 0.42
GFER P55789 1/20 0.42
HSD17B10 Q99714 1/20 0.42
GPR55 Q9Y2T6 1/20 0.42
TDP1 Q9NUW8 1/20 0.41
KMT2A Q03164 3/20 0.40
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39

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
SCHEMBL29882815 0.89 CES2 (0.60) PRSS1PRSS2PRSS3HTTCES2
SCHEMBL8642659 0.89 CES2 (0.60) PRSS1PRSS2PRSS3HTTCES2
SCHEMBL13846545 0.85 CES2 (0.47) PRSS1PRSS2PRSS3HTTCES2
SCHEMBL9823364 0.84 MEN1 (0.61) PRSS1PRSS2PRSS3HTTCES2
SCHEMBL902913 0.82 PRSS1 (0.52) PRSS1PRSS2PRSS3HTTCES2
SCHEMBL31484336 0.82 PRSS1 (0.52) PRSS1PRSS2PRSS3HTTCES2
SCHEMBL12824890 0.82 PRSS1 (0.64) PRSS1PRSS2PRSS3HTTCES2
SCHEMBL1363337 0.82 PRSS1 (0.52) PRSS1PRSS2PRSS3HTTCES2
SCHEMBL11872212 0.80 PRSS1 (0.50) PRSS1PRSS2PRSS3HTTCES2
SCHEMBL23476007 0.77 PRSS1 (0.47) PRSS1PRSS2PRSS3HTTCES2

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-0778853-B1 THERMOPLASTIC MOULDING MATERIAL BASF AG (DE) 1999-08-04 EP disclosed
US-5854353-A Thermoplastic molding compound BASF AKTIENGESELLSCHAFT (DE) 1998-12-29 US disclosed
EP-0778853-A2 THERMOPLASTIC MOULDING MATERIAL BASF AKTIENGESELLSCHAFT (DE) 1997-06-18 EP disclosed
WO-1995034586-A2 THERMOPLASTIC MOULDING MATERIAL BASF AKTIENGESELLSCHAFT (DE) 1995-12-21 WO disclosed
EP-0477679-B1 Living polymers, process for their preparation and their use for preparing telechelic polymers BASF AG (DE) 1995-12-06 EP disclosed
US-5321093-A Living polymers, the preparation thereof and the use thereof for preparing telechelic polymers BASF AKTIENGESELLSCHAFT (DE) 1994-06-14 US disclosed
EP-0477679-A2 Living polymers, process for their preparation and their use for preparing telechelic polymers BASF Aktiengesellschaft (DE) 1992-04-01 EP disclosed