SCHEMBL7701569

SCHEMBL7701569

Cc1nc2ccccn2c(=O)c1CCN1CCC(c2coc3cc(F)ccc23)CC1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 5/20 0.61
HTR1A P08908 3/20 0.61
CYP2D6 P10635 2/20 0.61
TSHR P16473 2/20 0.61
PMP22 Q01453 2/20 0.61
SMN1; SMN2 Q16637 2/20 0.61
KDM4E B2RXH2 1/20 0.61
MEN1 O00255 1/20 0.61
CYP3A4 P08684 1/20 0.61
MAPT P10636 1/20 0.61
PKM P14618 1/20 0.61
HPGD P15428 1/20 0.61
THPO P40225 1/20 0.61
KMT2A Q03164 1/20 0.61
ACHE P22303 2/20 0.59
ADRA2A P08913 8/20 0.51
ADRA2B P18089 8/20 0.51
ADRA2C P18825 8/20 0.51
ADRA1A P35348 8/20 0.51
DRD2 P14416 11/20 0.50

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
SCHEMBL7695963 0.87 ADRA2A (0.54) HTR2CHTR1ACYP2D6TSHRPMP22
SCHEMBL7703857 0.86 DRD2 (0.51) HTR2CHTR1ACYP2D6TSHRPMP22
SCHEMBL7700609 0.86 HTR2C (0.47) HTR2CHTR1ACYP2D6TSHRPMP22
SCHEMBL7699932 0.86 DRD2 (0.55) HTR2CHTR1ACYP2D6TSHRPMP22
SCHEMBL1443153 0.86 DRD2 (0.68) HTR2CHTR1ACYP2D6TSHRPMP22
SCHEMBL7317636 0.84 HTR2C (0.61) HTR2CHTR1ACYP2D6TSHRPMP22
SCHEMBL9491933 0.82 HTR2C (0.61) HTR2CHTR1ACYP2D6TSHRPMP22
SCHEMBL7697170 0.82 DRD2 (0.53) HTR2CHTR1ACYP2D6TSHRPMP22
SCHEMBL9279063 0.81 ADRA2A (0.53) HTR2CHTR1ACYP2D6TSHRPMP22
SCHEMBL9044427 0.80 HTR1A (0.59) HTR2CHTR1ACYP2D6TSHRPMP22

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-0672043-B1 NOVEL 4-(3-BENZOFURANYL)PIPERIDINYL AND 4-(3-BENZOTHIENYL)PIPERIDINYL DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM JANSSEN PHARMACEUTICA NV (BE) 2001-05-30 EP claimed
EP-0672043-A1 NOVEL 4-(3-BENZOFURANYL)PIPERIDINYL AND 4-(3-BENZOTHIENYL)PIPERIDINYL DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM JANSSEN PHARMACEUTICA N.V. (BE) 1995-09-20 EP claimed
WO-1994001437-A1 NOVEL 4-(3-BENZOFURANYL)PIPERIDINYL AND 4-(3-BENZOTHIENYL)PIPERIDINYL DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM JANSSEN PHARMACEUTICA N.V. (BE) 1994-01-20 WO claimed
US-6348457-B1 ANTAGONIZING RESERPINE IN MAMMALS JANSSEN PHARMACEUTICA N.V. (BE) 2002-02-19 US disclosed
EP-0672043-B1 NOVEL 4-(3-BENZOFURANYL)PIPERIDINYL AND 4-(3-BENZOTHIENYL)PIPERIDINYL DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM JANSSEN PHARMACEUTICA NV (BE) 2001-05-30 EP disclosed
EP-0672043-A1 NOVEL 4-(3-BENZOFURANYL)PIPERIDINYL AND 4-(3-BENZOTHIENYL)PIPERIDINYL DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM JANSSEN PHARMACEUTICA N.V. (BE) 1995-09-20 EP disclosed
WO-1994001437-A1 NOVEL 4-(3-BENZOFURANYL)PIPERIDINYL AND 4-(3-BENZOTHIENYL)PIPERIDINYL DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM JANSSEN PHARMACEUTICA N.V. (BE) 1994-01-20 WO disclosed