SCHEMBL9836286

SCHEMBL9836286

C=C(c1ccc(Br)cc1)C(O)C(=O)OC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.43
MAPT P10636 2/20 0.43
MEN1 O00255 2/20 0.43
LMNA P02545 2/20 0.43
MAPK1 P28482 1/20 0.43
RAB9A P51151 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
RXFP1 Q9HBX9 1/20 0.43
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
ALDH1A1 P00352 3/20 0.40
HPGD P15428 2/20 0.40
PKM P14618 1/20 0.40
ALOX12 P18054 1/20 0.40
HTT P42858 1/20 0.40
HSD17B10 Q99714 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
OGG1 O15527 1/20 0.39
CYP1A2 P05177 2/20 0.39
ATM Q13315 1/20 0.39

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
SCHEMBL9692672 0.84 TDP1 (0.50) KMT2AMAPTMEN1LMNARAB9A
SCHEMBL9690190 0.83 CA1 (0.52) MAPTRAB9ACES2CES1PKM
SCHEMBL9836428 0.83 ADRB2 (0.43) KMT2AMAPTMEN1LMNAMAPK1
SCHEMBL9691565 0.83 L3MBTL1 (0.46) KMT2AMAPTMEN1LMNARAB9A
SCHEMBL9692286 0.82 KMT2A (0.50) KMT2AMAPTLMNARAB9ANPSR1
SCHEMBL10888145 0.80 PDCD1 (0.46) KMT2AMAPTRAB9AALDH1A1HTT
SCHEMBL10890631 0.80 ALDH1A1 (0.47) KMT2AMAPTMEN1LMNARAB9A
SCHEMBL11646081 0.79 BCL2L1 (0.44) KMT2AMAPTMEN1LMNAMAPK1
SCHEMBL10887104 0.78 SRD5A2 (0.49) MAPTMAPK1RAB9AALDH1A1HPGD
SCHEMBL9692221 0.78 CXCR1 (0.49) KMT2AMEN1LMNAALDH1A1HPGD

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
EP-0241559-B1 OXAZOLIDINEDIONE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND HERBICIDES CONTAINING THE SAME SAGAMI CHEMICAL RESEARCH CENTER (JP) 1991-10-30 EP disclosed
US-4983751-A Chemical intermediates SAGAMI CHEMICAL RESEARCH CENTER (JP) 1991-01-08 US disclosed
US-4818272-A NONPHYTOTOXICITY FOR CROPS HELICAL STREAMS SAGAMI CHEMICAL RESEARCH CENTER (JP) 1989-04-04 US disclosed