SCHEMBL9711541

SCHEMBL9711541

Cc1cc(Br)ccc1C(=O)C1C(=O)CCNC1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 2/20 0.36
PARP11 Q9NR21 1/20 0.36
PARP1 P09874 1/20 0.36
FLT1 P17948 1/20 0.34
FLT4 P35916 1/20 0.34
KDR P35968 1/20 0.34
ALDH1A1 P00352 1/20 0.34
GAA P10253 1/20 0.34
NPC1 O15118 3/20 0.33
RAB9A P51151 3/20 0.33
TDP2 O95551 1/20 0.33
MAPT P10636 3/20 0.32
LMNA P02545 2/20 0.32
THRB P10828 1/20 0.32
CRBN Q96SW2 1/20 0.32
TSHR P16473 1/20 0.32
MEN1 O00255 1/20 0.32
ALOX15 P16050 1/20 0.32
ALOX12 P18054 1/20 0.32
HBB P68871 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
SCHEMBL9711534 0.80 ITGB1 (0.38) PARP10PARP11PARP1ALDH1A1NPC1
SCHEMBL9711452 0.80 NPC1 (0.44) PARP10PARP11PARP1NPC1RAB9A
SCHEMBL9711711 0.80 HPD (0.48) PARP10PARP11PARP1ALDH1A1RAB9A
SCHEMBL9711773 0.78 HPGD (0.43) ALDH1A1NPC1RAB9ALMNATSHR
SCHEMBL9711735 0.75 NPC1 (0.49) PARP1ALDH1A1GAANPC1RAB9A
SCHEMBL9711719 0.74 PARP10 (0.36) PARP10PARP11ALDH1A1GAAMEN1
SCHEMBL9711493 0.74 CYP1A2 (0.49) ALDH1A1GAANPC1RAB9AMAPT
SCHEMBL9711583 0.72 SMN1; SMN2 (0.44) PARP10PARP1ALDH1A1NPC1RAB9A
SCHEMBL9711707 0.72 HPD (0.48) ALDH1A1GAANPC1MAPTLMNA
SCHEMBL9711472 0.70 NOTUM (0.36) LMNACRBN

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