SCHEMBL6673111

SCHEMBL6673111

C=CC(O)C1NCCc2ccccc21

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PRCP P42785 8/20 0.61
SLC22A1 O15245 1/20 0.45
TSHR P16473 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
GAA P10253 1/20 0.45
RECQL P46063 1/20 0.42
MAPT P10636 1/20 0.40
GID4 Q8IVV7 1/20 0.39
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
HTR2B P41595 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
DRD1 P21728 1/20 0.38

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
SCHEMBL24845654 0.82 PRCP (0.71) PRCPSLC22A1TSHRNPSR1GAA
SCHEMBL28763199 0.81 PRCP (0.61) PRCPSLC22A1TSHRNPSR1GAA
SCHEMBL31569038 0.79 PRCP (0.77) PRCPSLC22A1TSHRNPSR1GAA
SCHEMBL31158625 0.76 PRCP (1.00) PRCPSLC22A1TSHRNPSR1GAA
SCHEMBL1012767 0.76 PRCP (1.00) PRCPSLC22A1TSHRNPSR1GAA
SCHEMBL24091985 0.76 PRCP (1.00) PRCPSLC22A1TSHRNPSR1GAA
SCHEMBL29768316 0.76 PRCP (1.00) PRCPSLC22A1TSHRNPSR1GAA
SCHEMBL5102163 0.76 PRCP (0.63) PRCPSLC22A1TSHRNPSR1GAA
SCHEMBL28209057 0.72 PRCP (0.71) PRCPSLC22A1TSHRNPSR1GAA
SCHEMBL4144168 0.72 PRCP (0.71) PRCPSLC22A1TSHRNPSR1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1149079-B1 TETRAHYDRO ISOQUINO LINEALKANOL DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME SK CORP (KR) 2004-04-21 EP disclosed
CN-1142913-C Tetrahydroisoquinolinealkanol derivatives and pharmaceutical compositions contg. same SK��ʽ���� 2004-03-24 CN disclosed
CN-1334804-A Tetrahydroisoquinolinealkanol derivatives and pharmaceutical compositions contg. same SK CORP (KR) 2002-02-06 CN disclosed
EP-1149079-A1 TETRAHYDRO ISOQUINO LINEALKANOL DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME SK Corporation (KR) 2001-10-31 EP disclosed
WO-2000046204-A1 TETRAHYDRO ISOQUINO LINEALKANOL DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME SK CORPORATION (KR) 2000-08-10 WO disclosed
US-5955471-A USEFUL IN THE TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS, INCLUDING DEPRESSION SK CORPORATION (US) 1999-09-21 US disclosed