SCHEMBL9711518

SCHEMBL9711518

Cc1ccccc1C(=S)C1C(=O)CCNC1=O

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.36
PARP10 Q53GL7 1/20 0.36
PARP11 Q9NR21 1/20 0.36
LMNA P02545 1/20 0.35
ITGB1 P05556 1/20 0.35
ITGA5 P08648 1/20 0.35
ALDH1A1 P00352 2/20 0.34
HTT P42858 2/20 0.34
HSD17B10 Q99714 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
NPC1 O15118 3/20 0.34
RAB9A P51151 2/20 0.34
DDB1 Q16531 1/20 0.34
CRBN Q96SW2 1/20 0.34
MAPT P10636 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL9711534 0.85 ITGB1 (0.38) PARP1PARP10PARP11LMNAITGB1
SCHEMBL9711494 0.73 SMN1; SMN2 (0.40) LMNAITGB1ITGA5ALDH1A1MAPT
SCHEMBL9711455 0.70 CES2 (0.42) ALDH1A1MAPTKMT2A
SCHEMBL9711668 0.67 KDM4E (0.47) LMNAALDH1A1HTTHSD17B10TDP1
SCHEMBL9711769 0.67 MEN1 (0.43) LMNAMEN1KMT2A
SCHEMBL7341520 0.66 P2RX7 (0.33) LMNAITGB1ITGA5ALDH1A1HTT
SCHEMBL9711486 0.66 ALDH1A1 (0.44) ALDH1A1HTTTDP1MEN1KMT2A
SCHEMBL10191381 0.66 NPC1 (0.45) HTTNPC1RAB9A
SCHEMBL9711493 0.66 CYP1A2 (0.49) LMNAALDH1A1HTTNPC1RAB9A
SCHEMBL13164040 0.65 ALDH1A1 (0.60) LMNAALDH1A1NPC1RAB9ACRBN

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
US-5114461-A Herbicides MAY & BAKER LIMITED (GB) 1992-05-19 US disclosed
EP-0278742-A2 Cyclic diones MAY & BAKER LIMITED (GB) 1988-08-17 EP disclosed