SCHEMBL7611941

SCHEMBL7611941

COCOc1ccc(C(c2ccc(OCOC)cc2)c2c(C(=O)N3CCN(c4ccccc4Cl)CC3)n(CCN3CCCCC3)c3ccccc23)cc1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 5/20 0.44
HTR2A P28223 2/20 0.44
SMN1; SMN2 Q16637 4/20 0.39
NPY1R P25929 1/20 0.39
HTR7 P34969 3/20 0.38
HTR1A P08908 3/20 0.38
HTR6 P50406 2/20 0.38
BCHE P06276 4/20 0.38
ACHE P22303 4/20 0.38
TP53 P04637 3/20 0.37
LMNA P02545 2/20 0.36
MAPT P10636 1/20 0.36
DRD1 P21728 1/20 0.36
ADRA1D P25100 1/20 0.36
ADRA1A P35348 1/20 0.36
ADRA1B P35368 1/20 0.36
ALDH1A1 P00352 1/20 0.36
TSHR P16473 1/20 0.36

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
SCHEMBL7617308 0.99 DRD2 (0.44) DRD2HTR2ASMN1; SMN2NPY1RHTR7
SCHEMBL7615685 0.95 DRD2 (0.43) DRD2HTR2ANPY1RHTR7HTR1A
SCHEMBL7615669 0.95 DRD2 (0.43) DRD2HTR2ANPY1RHTR7HTR1A
SCHEMBL7610391 0.93 DRD2 (0.43) DRD2HTR2ASMN1; SMN2HTR7HTR1A
SCHEMBL7617460 0.91 DRD2 (0.45) DRD2HTR2ASMN1; SMN2NPY1RHTR7
SCHEMBL7617302 0.91 DRD2 (0.41) DRD2HTR2ASMN1; SMN2HTR7HTR1A
SCHEMBL7608654 0.90 DRD2 (0.41) DRD2HTR2ASMN1; SMN2HTR7HTR1A
SCHEMBL7618168 0.90 DRD2 (0.42) DRD2HTR2ASMN1; SMN2HTR7HTR1A
SCHEMBL7618619 0.90 DRD2 (0.42) DRD2HTR2ASMN1; SMN2HTR7HTR1A
SCHEMBL7616570 0.89 DRD2 (0.40) DRD2HTR2ASMN1; SMN2HTR7HTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0741132-B1 INDOLE DERIVATIVES KYOWA HAKKO KOGYO KK (JP) 2002-04-10 EP disclosed
EP-0741132-A1 INDOLE DERIVATIVE KYOWA HAKKO KOGYO CO., LTD. (JP) 1996-11-06 EP disclosed