SCHEMBL9237606

SCHEMBL9237606

C[Si]1(C(Cl)Cc2ccccc2)CCCCO1

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 4/20 0.33
SIGMAR1 Q99720 4/20 0.33
SLC6A2 P23975 2/20 0.33
MAOA P21397 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
CYP2A6 P11509 1/20 0.33
ADORA2A P29274 1/20 0.33
ADORA1 P30542 1/20 0.33
CYP2D6 P10635 2/20 0.32
SLC18A2 Q05940 1/20 0.32
EPHX1 P07099 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
TRPA1 O75762 1/20 0.31
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
TSHR P16473 1/20 0.30
CYP2C19 P33261 1/20 0.30

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
SCHEMBL17048844 0.83 SIGMAR1 (0.38) TAAR1SIGMAR1SLC6A2MAOASLC6A4
SCHEMBL10936708 0.71 CYP2D6 (0.32) SLC6A3CYP2D6
SCHEMBL2239337 0.71 LMNA (0.34) TAAR1TRPA1TSHR
SCHEMBL9308520 0.69 TP53 (0.31)
SCHEMBL16459396 0.69
SCHEMBL16461174 0.68 TRPA1 (0.33) TRPA1
SCHEMBL16460379 0.68
SCHEMBL338865 0.67 SLC6A3 (0.33) TAAR1SIGMAR1SLC6A3CYP2A6SLC18A2
SCHEMBL16459657 0.67
SCHEMBL4355743 0.65 CALM1 (0.31)

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-0667029-A1 THIXOTROPIC MAGNETORHEOLOGICAL MATERIALS LORD CORPORATION (US) 1995-08-16 EP claimed
EP-0667029-A4 THIXOTROPIC MAGNETORHEOLOGICAL MATERIALS. LORD CORP (US) 1995-06-13 EP claimed
WO-1994010693-A1 THIXOTROPIC MAGNETORHEOLOGICAL MATERIALS LORD CORPORATION (US) 1994-05-11 WO claimed