SCHEMBL8618033

SCHEMBL8618033

CC(C)Oc1c(Cl)cccc1C(O)CN1CCCC1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.42
DRD2 P14416 2/20 0.41
DRD3 P35462 2/20 0.41
MAOB P27338 1/20 0.41
LTA4H P09960 1/20 0.39
TSHR P16473 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
KMT2A Q03164 2/20 0.38
ADRB2 P07550 1/20 0.38
ADRB1 P08588 1/20 0.38
MEN1 O00255 1/20 0.37
USP2 O75604 1/20 0.37
HTT P42858 1/20 0.37
ACE2 Q9BYF1 1/20 0.37

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
SCHEMBL8617655 0.83 POLB (0.47) L3MBTL1DRD2KMT2AMEN1
SCHEMBL8617649 0.75 AOC3 (0.48) SMN1; SMN2ADRB2ADRB1
SCHEMBL8619834 0.73 AOC3 (0.42) ADRB2ADRB1
SCHEMBL8620885 0.73 ADRB2 (0.50) L3MBTL1TSHRADRB2ADRB1HTT
SCHEMBL8622440 0.72 AOC3 (0.44) ADRB2ADRB1
SCHEMBL13408062 0.71 CYP1A2 (0.42) TSHR
SCHEMBL5736618 0.70 L3MBTL1 (0.49) L3MBTL1MAOBSMN1; SMN2KMT2AMEN1
SCHEMBL6551819 0.70 L3MBTL1 (0.52) L3MBTL1MAOBKMT2AMEN1
N-Methyl Pyrrolidine (Nmp) SCHEMBL27406527 0.69 KDM4E (0.36) DRD2DRD3SMN1; SMN2KMT2AMEN1
SCHEMBL17755155 0.69 SLC6A4 (0.47) L3MBTL1TSHRKMT2A

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-0651735-B1 PHARMACOLOGICALLY ACTIVE ALPHA-(TERTIARY-AMINOMETHYL)-PHENYLMETHANOL DERIVATIVES PHARMACIA & UPJOHN AB (SE) 1998-05-20 EP claimed
US-5527821-A FOR TREATMENT OF URINARY INCONTINENCE PHARMACIA AB (SE) 1996-06-18 US claimed
EP-0651735-A1 PHARMACOLOGICALLY ACTIVE ALPHA-(TERTIARY-AMINOMETHYL)-PHENYLMETHANOL DERIVATIVES Pharmacia & Upjohn Aktiebolag (SE) 1995-05-10 EP claimed
WO-1994002442-A1 PHARMACOLOGICALLY ACTIVE α-[TERTIARY-AMINOMETHYL]-BENZENEMETHANOL DERIVATIVES PHARMACIA AB (SE) 1994-02-03 WO claimed
EP-0651735-B1 PHARMACOLOGICALLY ACTIVE ALPHA-(TERTIARY-AMINOMETHYL)-PHENYLMETHANOL DERIVATIVES PHARMACIA & UPJOHN AB (SE) 1998-05-20 EP disclosed
US-5527821-A FOR TREATMENT OF URINARY INCONTINENCE PHARMACIA AB (SE) 1996-06-18 US disclosed
EP-0651735-A1 PHARMACOLOGICALLY ACTIVE ALPHA-(TERTIARY-AMINOMETHYL)-PHENYLMETHANOL DERIVATIVES Pharmacia & Upjohn Aktiebolag (SE) 1995-05-10 EP disclosed
WO-1994002442-A1 PHARMACOLOGICALLY ACTIVE α-[TERTIARY-AMINOMETHYL]-BENZENEMETHANOL DERIVATIVES PHARMACIA AB (SE) 1994-02-03 WO disclosed