SCHEMBL7436148

SCHEMBL7436148

Oc1ccc([C@@H]2CNC[C@H]2Cc2c(O)ccc(Cl)c2O)cc1O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
QDPR P09417 2/20 0.39
MEN1 O00255 1/20 0.34
POLB P06746 1/20 0.34
GAA P10253 1/20 0.34
KMT2A Q03164 1/20 0.34
GRK2 P25098 1/20 0.34
SLC6A2 P23975 9/20 0.33
SLC6A4 P31645 9/20 0.33
SLC6A3 Q01959 5/20 0.33
MAPK1 P28482 2/20 0.33
CYP3A4 P08684 1/20 0.33
ALOX15 P16050 1/20 0.33
TSHR P16473 1/20 0.33
NFKB1 P19838 1/20 0.33
THPO P40225 1/20 0.33
HSD17B10 Q99714 1/20 0.33
PARP1 P09874 1/20 0.33
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL7294900 1.00 QDPR (0.39) QDPRMEN1POLBGAAKMT2A
SCHEMBL7436138 1.00 QDPR (0.39) QDPRMEN1POLBGAAKMT2A
SCHEMBL7430268 0.84 PARP1 (0.44) QDPRMEN1POLBGAAKMT2A
SCHEMBL7302987 0.84 PARP1 (0.44) QDPRMEN1POLBGAAKMT2A
SCHEMBL7430243 0.84 PARP1 (0.44) QDPRMEN1POLBGAAKMT2A
SCHEMBL7431434 0.82 PARP1 (0.36) QDPRMEN1POLBGAAKMT2A
SCHEMBL7431416 0.82 PARP1 (0.36) QDPRMEN1POLBGAAKMT2A
SCHEMBL7431423 0.82 PARP1 (0.36) QDPRMEN1POLBGAAKMT2A
Bromide SCHEMBL9150727 0.81 PARP1 (0.36) QDPRMEN1POLBGAAKMT2A
Bromide SCHEMBL9150707 0.81 PARP1 (0.36) QDPRMEN1POLBGAAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0381235-B1 PYRROLIDINE COMPOUND AND PHARMACEUTICAL USE Eisai Co., Ltd. (JP) 1993-07-28 EP disclosed