SCHEMBL9535121

SCHEMBL9535121

O=C(O)C1C(C(=O)O)[C@H]2C[C@@H]1CC2O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.38
POLB P06746 2/20 0.38
PKM P14618 1/20 0.35
GRM2 Q14416 5/20 0.34
GRM4 Q14833 3/20 0.34
GRM3 Q14832 2/20 0.34
GRM8 O00222 1/20 0.34
KMT2A Q03164 1/20 0.32
GRM5 P41594 4/20 0.31
GRM6 O15303 2/20 0.31
GRM1 Q13255 2/20 0.31
APEX1 P27695 1/20 0.31
KDM4E B2RXH2 1/20 0.31
GMNN O75496 1/20 0.31
LMNA P02545 1/20 0.31
PMP22 Q01453 1/20 0.31
TFPI2 P48307 1/20 0.31
TP53 P04637 1/20 0.31
TSHR P16473 1/20 0.31
NFKB1 P19838 1/20 0.31

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
SCHEMBL5795999 1.00 TDP1 (0.38) TDP1POLBPKMGRM2GRM4
SCHEMBL3779680 0.87 POLB (0.33) TDP1POLBPKMGRM2GRM4
SCHEMBL27218570 0.82 POLB (0.42) TDP1POLBPKMGRM2GRM4
SCHEMBL13170561 0.76 GABRR1 (0.39) TDP1POLBPKMGRM2GRM4
SCHEMBL13170558 0.76 GABRR1 (0.39) TDP1POLBPKMGRM2GRM4
SCHEMBL3137346 0.76 GABRR1 (0.39) TDP1POLBPKMGRM2GRM4
SCHEMBL13170560 0.76 GABRR1 (0.39) TDP1POLBPKMGRM2GRM4
SCHEMBL13170557 0.76 GABRR1 (0.39) TDP1POLBPKMGRM2GRM4
SCHEMBL3791279 0.76 GABRR1 (0.39) TDP1POLBPKMGRM2GRM4
SCHEMBL3683146 0.76 POLB (0.43) TDP1POLBGRM2GRM4GRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0314098-B1 IMIDE DERIVATIVES, THEIR PRODUCTION AND USE SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1993-08-04 EP disclosed
EP-0261688-B1 IMIDE DERIVATIVES, AND THEIR PRODUCTION AND USE SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1992-03-25 EP disclosed
US-4948799-A ANTIPSYCHOTIC DRUGS SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1990-08-14 US disclosed
US-4937249-A Neuroleptic agents SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1990-06-26 US disclosed
US-4812461-A Imide derivatives and their use in the treatment psychosis SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1989-03-14 US disclosed