SCHEMBL8475904

SCHEMBL8475904

CCOC(=O)c1c(C(c2ccccc2)c2ccc(OCCCl)cc2)c2ccccc2n1C(C)C1CCCN1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 7/20 0.41
SLC6A2 P23975 5/20 0.41
SLC6A4 P31645 3/20 0.41
GPR88 Q9GZN0 4/20 0.40
DHFR P00374 1/20 0.35
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
TSHR P16473 1/20 0.34
TDP1 Q9NUW8 1/20 0.34

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
SCHEMBL8898490 0.91 GPR88 (0.43) SLC6A3SLC6A2SLC6A4GPR88DHFR
SCHEMBL8473779 0.91 SLC6A3 (0.48) SLC6A3SLC6A2SLC6A4GPR88DHFR
SCHEMBL8474902 0.91 SLC6A2 (0.41) SLC6A3SLC6A2SLC6A4GPR88LMNA
SCHEMBL8474565 0.89 SLC6A3 (0.42) SLC6A3SLC6A2SLC6A4GPR88DHFR
SCHEMBL8477380 0.88 SLC6A3 (0.42) SLC6A3SLC6A2SLC6A4DHFR
SCHEMBL8475897 0.82 NPY1R (0.38) SLC6A3SLC6A2SLC6A4GPR88ALDH1A1
SCHEMBL8472000 0.82 HTR2C (0.43) SLC6A3SLC6A2SLC6A4GPR88ALDH1A1
SCHEMBL8477072 0.80 GPR88 (0.45) SLC6A3SLC6A2SLC6A4GPR88DHFR
SCHEMBL8472627 0.80 SLC6A3 (0.43) SLC6A3SLC6A2SLC6A4GPR88DHFR
SCHEMBL8477091 0.79 GPR88 (0.39) SLC6A3SLC6A2SLC6A4GPR88DHFR

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