SCHEMBL7363898

SCHEMBL7363898

CN1C(C(=O)O)C1C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.32
TDP1 Q9NUW8 2/20 0.31
FFAR3 O14843 1/20 0.31
LCK P06239 1/20 0.31
FYN P06241 1/20 0.31
POLB P06746 1/20 0.30
CTDSP1 Q9GZU7 1/20 0.30
ALDH1A1 P00352 1/20 0.30
SUCNR1 Q9BXA5 1/20 0.30
MAPT P10636 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
SCHEMBL7356915 1.00 TP53 (0.32) TP53TDP1FFAR3LCKFYN
SCHEMBL23342976 0.74 TP53 (0.30) TP53
SCHEMBL9281731 0.72 HPSE (0.32)
SCHEMBL204261 0.70 TDP1 (0.36) TDP1ALDH1A1
SCHEMBL4648895 0.70 TDP1 (0.36) TDP1ALDH1A1
SCHEMBL4895931 0.70 TDP1 (0.36) TDP1ALDH1A1
SCHEMBL23465218 0.70 TDP1 (0.32) TDP1
SCHEMBL17795772 0.70 TDP1 (0.36) TDP1ALDH1A1
SCHEMBL8018713 0.70 TSHR (0.30)
SCHEMBL30997280 0.70 TDP1 (0.32) TDP1

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
EP-0753003-A1 AZIRIDINE DERIVATIVES, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1997-01-15 EP disclosed
WO-1995028416-A1 AZIRIDINE DERIVATIVES, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1995-10-26 WO disclosed