SCHEMBL8813402

SCHEMBL8813402

Cc1c(Br)cccc1C(=O)CC(=O)C1CC1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
F2R P25116 3/20 0.36
KMT2A Q03164 3/20 0.36
MEN1 O00255 1/20 0.35
MAPT P10636 2/20 0.35
ALDH1A1 P00352 2/20 0.35
HPGD P15428 1/20 0.35
HSD17B10 Q99714 1/20 0.35
RAB9A P51151 1/20 0.35
TAS1R3 Q7RTX0 1/20 0.35
TAS1R1 Q7RTX1 1/20 0.35
TAS1R2 Q8TE23 1/20 0.35
CASP3 P42574 1/20 0.34
SENP8 Q96LD8 1/20 0.34
SENP7 Q9BQF6 1/20 0.34
SENP6 Q9GZR1 1/20 0.34
SIRT5 Q9NXA8 1/20 0.34
HSD11B1 P28845 1/20 0.34
ERCC5 P28715 1/20 0.34
FEN1 P39748 1/20 0.34

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
SCHEMBL8816163 0.82 ESR1 (0.44) KMT2AMEN1RAB9ATAS1R3TAS1R1
SCHEMBL8729992 0.79 SMN1; SMN2 (0.36) F2RKMT2AMEN1MAPTALDH1A1
SCHEMBL8754605 0.78 ERCC5 (0.57) KMT2AMEN1ALDH1A1HPGDRAB9A
SCHEMBL8145611 0.77 KMT2A (0.43) KMT2AMEN1MAPTALDH1A1HPGD
SCHEMBL25181502 0.77 F2R (0.43) F2RKMT2AALDH1A1HPGDRAB9A
SCHEMBL30373676 0.77 F2R (0.43) F2RKMT2AALDH1A1HPGDRAB9A
SCHEMBL8443704 0.73 ERCC5 (0.61) KMT2AMEN1TAS1R3TAS1R1TAS1R2
SCHEMBL16014081 0.73 HPGD (0.39) KMT2AMEN1MAPTALDH1A1HPGD
SCHEMBL8813464 0.73 HPGD (0.42) KMT2AMEN1MAPTALDH1A1HPGD
SCHEMBL8813179 0.73 SLC6A4 (0.45) KMT2AMEN1RAB9ATAS1R3TAS1R1

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
WO-1997023491-A1 NEW HERBICIDES RHONE-POULENC AGRICULTURE LTD. (GB) 1997-07-03 WO disclosed