SCHEMBL8068906

SCHEMBL8068906

CC1=C(CBr)C(=O)OC(C)(C)O1

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 4/20 0.34
▸ LMNA P02545 2/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ ACP1 P24666 2/20 0.33
▸ CDC25B P30305 2/20 0.33
▸ CYP2C9 P11712 1/20 0.31
▸ ALDH1A1 P00352 6/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ HTT P42858 1/20 0.30

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
SCHEMBL7428431 0.81 PTPN1 (0.37) PTPN1LMNAHSD17B10ACP1CDC25B
SCHEMBL8205778 0.76 PTPN1 (0.40) PTPN1LMNAHSD17B10ACP1CDC25B
SCHEMBL21996373 0.75 PTPN1 (0.39) PTPN1LMNAHSD17B10ACP1CDC25B
SCHEMBL10519826 0.71 PTPN1 (0.38) PTPN1LMNAHSD17B10ACP1CDC25B
SCHEMBL8477691 0.71 KDM4E (0.31) L3MBTL1
SCHEMBL10572506 0.70 PTPN1 (0.40) PTPN1LMNAHSD17B10ACP1CDC25B
SCHEMBL9730908 0.68 — —
SCHEMBL10519639 0.67 PTPN1 (0.38) PTPN1LMNAHSD17B10ACP1CDC25B
SCHEMBL17923128 0.67 PTPN1 (0.38) PTPN1LMNAHSD17B10ACP1CDC25B
SCHEMBL8306149 0.67 PTPN1 (0.38) PTPN1LMNAHSD17B10ACP1CDC25B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6080771-A LEINAMYCIN DERIVATIVES ARE USED AS BACTERICIDE AND ANTITUMOR AGENTS KYOWA HAKKO KOGYO CO., LTD. (JP) 2000-06-27 — — US disclosed
US-5981558-A ANTIMICROBIAL ACTIVITY AND ANTITUMOR ACTIVITY KYOWA HAKKO KOGYO CO., LTD. (JP) 1999-11-09 — — US disclosed
EP-0918058-A1 DC 107 DERIVATIVES (1) KYOWA HAKKO KOGYO CO., LTD. (JP) 1999-05-26 — — EP disclosed
EP-0887351-A1 DC 107 DERIVATIVES (2) KYOWA HAKKO KOGYO CO., LTD. (JP) 1998-12-30 — — EP disclosed
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