SCHEMBL8718296

SCHEMBL8718296

S=C(S)c1cccc(Cl)c1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.54
PKM P14618 1/20 0.47
CTSL P07711 1/20 0.47
TSHR P16473 1/20 0.46
POLB P06746 2/20 0.46
KDM4E B2RXH2 2/20 0.45
ALDH1A1 P00352 1/20 0.45
ERCC5 P28715 1/20 0.44
FEN1 P39748 1/20 0.44
HTT P42858 1/20 0.44
GRIN2B Q13224 1/20 0.43

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
SCHEMBL9275420 0.81 PARP1 (0.54) PARP1PKMCTSLTSHRPOLB
SCHEMBL70253 0.79 PARP1 (0.63) PARP1PKMCTSLTSHRKDM4E
SCHEMBL21981592 0.79 PARP1 (0.52) PARP1PKMCTSLTSHRPOLB
SCHEMBL9275417 0.79 PARP1 (0.63) PARP1PKMPOLBALDH1A1ERCC5
SCHEMBL18380959 0.79 PARP1 (0.52) PARP1TSHRPOLBKDM4EALDH1A1
SCHEMBL13221047 0.79 CTSL (0.54) PARP1PKMCTSLTSHRPOLB
SCHEMBL4088684 0.77 PARP1 (0.60) PARP1PKMTSHRPOLBKDM4E
SCHEMBL8712276 0.76 CA12 (0.52) PARP1CTSLTSHRKDM4EALDH1A1
SCHEMBL10839681 0.75 PARP1 (0.58) PARP1TSHRPOLBKDM4EALDH1A1
SCHEMBL8712837 0.74 C1S (0.52) PARP1CTSLALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5847061-A Process for producing polymers having terminal functional group which may be protected KURARAY CO., LTD. (JP) 1998-12-08 US disclosed
EP-0704460-B1 PROCESS FOR PRODUCING POLYMER TERMINATED WITH OPTIONALLY PROTECTED FUNCTIONAL GROUP KURARAY CO (JP) 1998-11-04 EP disclosed
EP-0704460-A1 PROCESS FOR PRODUCING POLYMER TERMINATED WITH OPTIONALLY PROTECTED FUNCTIONAL GROUP KURARAY CO., LTD. (JP) 1996-04-03 EP disclosed