SCHEMBL7660854

SCHEMBL7660854

CC(=O)OC[C@H]1O[C@@H](Oc2ccc(N)cc2)[C@H](O)[C@@H](O)[C@H]1O

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TYR P14679 1/20 0.49
▸ TDP1 Q9NUW8 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.47
▸ LMNA P02545 1/20 0.47
▸ POLB P06746 1/20 0.47
▸ SLC5A1 P13866 2/20 0.44
▸ SLC5A2 P31639 2/20 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
SCHEMBL7660861 1.00 TYR (0.49) TYRTDP1ALDH1A1LMNAPOLB
SCHEMBL29382061 0.88 TYR (0.64) TYRTDP1ALDH1A1LMNAPOLB
SCHEMBL12870299 0.87 TDP1 (0.53) TYRTDP1ALDH1A1LMNAPOLB
SCHEMBL10031322 0.87 TYR (0.48) TYRTDP1ALDH1A1LMNAPOLB
SCHEMBL10119569 0.84 ALDH1A1 (0.49) TYRTDP1ALDH1A1LMNAPOLB
SCHEMBL15198140 0.84 ALDH1A1 (0.49) TYRTDP1ALDH1A1LMNAPOLB
SCHEMBL30186557 0.84 TYR (0.46) TYRTDP1
SCHEMBL15198316 0.84 ALDH1A1 (0.49) TYRTDP1ALDH1A1LMNAPOLB
SCHEMBL10108864 0.84 ALDH1A1 (0.49) TYRTDP1ALDH1A1LMNAPOLB
SCHEMBL7661748 0.84 TYR (0.54) TYRTDP1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6492335-B1 Glycoconjugates from modified camptothecin derivatives (20-O-linkage) BAYER AKTIENGESELLSCHAFT (DE) 2002-12-10 — — US disclosed
EP-0934329-B1 GLYCOCONJUGATES FROM MODIFIED CAMPTOTHECIN DERIVATES (20-O-LINKAGE) BAYER AG (DE) 2001-12-12 — — EP disclosed
EP-0939765-B1 GLYCOCONJUGATES OF MODIFIED CAMPTOTHECIN DERIVATIVES (A- OR B-RING LINKAGE) BAYER AG (DE) 2001-12-05 — — EP disclosed
US-6271342-B1 SERUM STABILITY; FOR TUMOR THERAPY BAYER AKTIENGESELLSCHAFT (DE) 2001-08-07 — — US disclosed
US-6156754-A Glycoconjugates of modified camptothecin derivatives (A-or B-ring linkage) BAYER AKTIENGESELLSCHAFT (DE) 2000-12-05 — — US disclosed
EP-0819135-B1 SUGAR-MODIFIED CYTOSTATICS BAYER AG (DE) 1999-11-17 — — EP disclosed
CN-1185786-A Sugar-modified cytostatics BAYER AG (DE) 1998-06-24 — — CN disclosed
Send feedback