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SCHEMBL8477380

SCHEMBL8477380

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

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ SLC6A3 Q01959 5/20 0.42
▸ SLC6A2 P23975 4/20 0.42
▸ SLC6A4 P31645 3/20 0.42
▸ ELANE P08246 2/20 0.38
▸ DHFR P00374 1/20 0.35

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
SCHEMBL8473779 0.95 SLC6A3 (0.48) SLC6A3SLC6A2SLC6A4ELANEDHFR
SCHEMBL8474565 0.89 SLC6A3 (0.42) SLC6A3SLC6A2SLC6A4DHFR
SCHEMBL8475103 0.88 SLC6A3 (0.38) SLC6A3SLC6A2SLC6A4DHFR
SCHEMBL8475904 0.88 SLC6A3 (0.41) SLC6A3SLC6A2SLC6A4DHFR
SCHEMBL8474902 0.88 SLC6A2 (0.41) SLC6A3SLC6A2SLC6A4
Hydrochloric Acid SCHEMBL8473192 0.86 ALDH1A1 (0.37) SLC6A3SLC6A2
SCHEMBL8472627 0.82 SLC6A3 (0.43) SLC6A3SLC6A2SLC6A4DHFR
SCHEMBL8473691 0.81 SLC6A3 (0.43) SLC6A3SLC6A2SLC6A4DHFR
SCHEMBL8477377 0.80 HTR6 (0.39) SLC6A3SLC6A2SLC6A4ELANE
Hydrochloric Acid SCHEMBL8474176 0.78 SLC6A3 (0.39) SLC6A3SLC6A2SLC6A4DHFR

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