SCHEMBL8143643

SCHEMBL8143643

O=C(Cl)N1CCC(N2CCOCC2)CC1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL3 Q96JM7 2/20 0.55
L3MBTL1 Q9Y468 2/20 0.55
EPHX2 P34913 3/20 0.47
LMNA P02545 1/20 0.47
KDM4E B2RXH2 4/20 0.45
ALDH1A1 P00352 3/20 0.45
ACHE P22303 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
CBX7 O95931 1/20 0.42
CDYL2 Q8N8U2 1/20 0.42
CDYL Q9Y232 1/20 0.42
CDY1; CDY1B Q9Y6F8 1/20 0.42
HRH3 Q9Y5N1 3/20 0.41
ACACB O00763 1/20 0.40
ACACA Q13085 1/20 0.40

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
SCHEMBL27991280 0.84 L3MBTL3 (0.58) L3MBTL3L3MBTL1EPHX2LMNAKDM4E
SCHEMBL4315788 0.82 L3MBTL3 (0.57) L3MBTL3L3MBTL1EPHX2LMNAKDM4E
SCHEMBL8141367 0.82 L3MBTL3 (0.56) L3MBTL3L3MBTL1
SCHEMBL8144136 0.81 SMN1; SMN2 (0.61) L3MBTL3L3MBTL1EPHX2LMNAKDM4E
SCHEMBL5779438 0.81 L3MBTL3 (0.55) L3MBTL3L3MBTL1EPHX2LMNAKDM4E
SCHEMBL1401624 0.80 L3MBTL3 (0.58) L3MBTL3L3MBTL1KDM4EALDH1A1
SCHEMBL8702 0.79
Hydrochloric Acid SCHEMBL457517 0.78 L3MBTL3 (0.56) L3MBTL3L3MBTL1KDM4EALDH1A1
SCHEMBL5731597 0.77 L3MBTL3 (0.44) L3MBTL3L3MBTL1EPHX2LMNAKDM4E
SCHEMBL5731598 0.77 L3MBTL3 (0.44) L3MBTL3L3MBTL1EPHX2LMNAKDM4E

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-6025385-A HIGH SOLUBILITY IN WATER AND ALSO HAS EXCELLENT ANTITUMOR ACTIVITIES. KABUSHIKI KAISHA YAKULT HONSHA (JP) 2000-02-15 US disclosed
EP-0930309-A1 TAXANE DERIVATIVES AND DRUGS CONTAINING THE SAME KABUSHIKI KAISHA YAKULT HONSHA (JP) 1999-07-21 EP disclosed