SCHEMBL8472571

SCHEMBL8472571

CCOC(=O)c1[nH]c2ccccc2c1C(c1ccccc1)c1ccc(OCCN2CCCC2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.52
DRD3 P35462 2/20 0.52
LTA4H P09960 2/20 0.50
KDM4E B2RXH2 3/20 0.49
MEN1 O00255 1/20 0.47
POLB P06746 1/20 0.47
APOBEC3A P31941 1/20 0.47
CASP6 P55212 1/20 0.47
KMT2A Q03164 1/20 0.47
APOBEC3G Q9HC16 1/20 0.47
ALDH1A1 P00352 2/20 0.47
HRH3 Q9Y5N1 4/20 0.46
KCNH2 Q12809 1/20 0.45
NR1H4 Q96RI1 2/20 0.44
TUBB4A P04350 1/20 0.44
TUBB P07437 1/20 0.44
TUBA3C P0DPH7 1/20 0.44
TUBA1B P68363 1/20 0.44
TUBA4A P68366 1/20 0.44
TUBB4B P68371 1/20 0.44

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
SCHEMBL8472659 0.89 MEN1 (0.59) DRD2DRD3LTA4HMEN1POLB
SCHEMBL8472467 0.86 LTA4H (0.51) DRD2DRD3LTA4HKDM4EMEN1
SCHEMBL8472673 0.85 HRH3 (0.48) DRD2DRD3LTA4HKDM4EMEN1
SCHEMBL8472895 0.84 HTR6 (0.55) DRD2DRD3KDM4EMEN1POLB
SCHEMBL8472570 0.83 MEN1 (0.44) DRD2DRD3KDM4EMEN1POLB
SCHEMBL8472591 0.82 MEN1 (0.62) DRD2DRD3KDM4EMEN1POLB
SCHEMBL8472324 0.82 MEN1 (0.53) DRD2DRD3KDM4EMEN1POLB
SCHEMBL8476781 0.81 EPHX2 (0.48) DRD2DRD3LTA4HMEN1POLB
SCHEMBL8472281 0.81 HRH3 (0.47) DRD2DRD3LTA4HMEN1POLB
SCHEMBL8474563 0.80 LTA4H (0.50) LTA4HKDM4EALDH1A1HRH3KCNH2

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
US-5891902-A OSTEOPOROSIS KYOWA HAKKO KOGYO CO., LTD. (JP) 1999-04-06 US disclosed
EP-0782989-A1 INDOLE DERIVATIVES KYOWA HAKKO KOGYO CO., LTD. (JP) 1997-07-09 EP disclosed