SCHEMBL6940069

SCHEMBL6940069

C=CCSc1nnc(Cl)c2c1CCCC2

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
ALDH1A1 P00352 1/20 0.37
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.32
HTT P42858 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
LMNA P02545 1/20 0.32
RAB9A P51151 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
SCHEMBL6937349 0.76 L3MBTL1 (0.35) TDP1L3MBTL1ALDH1A1TSHRMAPK1
SCHEMBL6937153 0.74 ALDH1A1 (0.33) TDP1L3MBTL1ALDH1A1TSHR
SCHEMBL15623942 0.71
SCHEMBL587789 0.71 MAPK1 (0.37) ALDH1A1MAPK1HTTLMNA
SCHEMBL30101051 0.71 MAPK1 (0.37) ALDH1A1MAPK1HTTLMNA
SCHEMBL6935201 0.70 ALDH1A1 (0.42) TDP1L3MBTL1ALDH1A1TSHRMAPK1
SCHEMBL24379631 0.69 NSD2 (0.35) MAPK1HTT
SCHEMBL30932816 0.69 NSD2 (0.35) MAPK1HTT
SCHEMBL26163823 0.69 NSD2 (0.35) MAPK1HTT
SCHEMBL28934784 0.69 NSD2 (0.35) MAPK1HTT

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-1058681-B1 NOVEL ALLYLTHIOPYRIDAZINE DERIVATIVES AND PROCESS FOR PREPARING THE SAME SEOUL PHARM CO LTD (KR) 2003-05-07 EP disclosed
US-5942511-A PROTECTION OF HUMAN TISSUE FROM RADIATION Kwon, Soon Kyoung (KR) 1999-08-24 US disclosed