SCHEMBL8124017

SCHEMBL8124017

COC(=O)c1ccc(NC(C)C)c2c1OC(C)(C)C2

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
KDM4E B2RXH2 6/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
MAPT P10636 2/20 0.35
ALDH1A1 P00352 9/20 0.34
LMNA P02545 2/20 0.34
HSD17B10 Q99714 2/20 0.33
HPGD P15428 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
HTT P42858 2/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C19 P33261 1/20 0.32
FFAR4 Q5NUL3 1/20 0.32

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
SCHEMBL8125096 0.87 MEN1 (0.40) MEN1KMT2AKDM4ESMN1; SMN2MAPT
SCHEMBL8131719 0.83 SMN1; SMN2 (0.40) MEN1KMT2AKDM4ESMN1; SMN2MAPT
SCHEMBL8118204 0.80 ALDH1A1 (0.43) KDM4EMAPTALDH1A1LMNAHSD17B10
SCHEMBL4242110 0.79 NPSR1 (0.39) MEN1KMT2ASMN1; SMN2MAPTALDH1A1
SCHEMBL22032209 0.79 LMNA (0.36) MEN1KMT2AKDM4ESMN1; SMN2MAPT
SCHEMBL8939971 0.79 FFAR4 (0.41) KMT2AKDM4ESMN1; SMN2ALDH1A1LMNA
SCHEMBL22032240 0.74 CA12 (0.41) KDM4ESMN1; SMN2MAPTALDH1A1LMNA
SCHEMBL21954934 0.74 EZH2 (0.39) MEN1KMT2AKDM4ESMN1; SMN2MAPT
SCHEMBL10320605 0.74 ALDH1A1 (0.43) KDM4EMAPTALDH1A1LMNAHSD17B10
SCHEMBL8068920 0.73 FFAR4 (0.43) KMT2AKDM4ESMN1; SMN2ALDH1A1LMNA

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-0445862-B1 N-(4-piperidinyl)(dihydrobenzofuran or dihydro-2H-benzopyran)carboxamide derivatives JANSSEN PHARMACEUTICA NV (BE) 2000-04-19 EP disclosed
CN-1038936-C N-(4-Piperidinyl) (dihydrobenzofuran or dihydro-2H-benzopyran) Carboxamide derivatives JANSSEN PHARMACEUTICA NV (BE) 1998-07-01 CN disclosed
US-5262418-A Laxatives, gastrointestinal disorders TANSSEN PHARMACEUTICA N.V. (BE) 1993-11-16 US disclosed
US-5185335-A Administer to mammals to stimulate gastrointestinal motility JANSSEN PHARMACEUTICA N.V. (BE) 1993-02-09 US disclosed
CN-1054598-A The preparation method of carboxamides derivatives JANSSEN PHARMACEUTICA NV (BE) 1991-09-18 CN disclosed
EP-0445862-A2 N-(4-piperidinyl)(dihydrobenzofuran or dihydro-2H-benzopyran)carboxamide derivatives JANSSEN PHARMACEUTICA N.V. (BE) 1991-09-11 EP disclosed