SCHEMBL27449802

SCHEMBL27449802

CON=C(C(=O)OC)c1ccccc1CCBr

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 8/20 0.57
ALDH1A1 P00352 3/20 0.42
LMNA P02545 2/20 0.42
HPGD P15428 1/20 0.35
FOLH1 Q04609 1/20 0.34
TSHR P16473 1/20 0.34
NPC1 O15118 2/20 0.33
POLB P06746 1/20 0.33
SCN1A P35498 1/20 0.33
SCN2A Q99250 1/20 0.33
SCN3A Q9NY46 1/20 0.33
HTT P42858 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
SCHEMBL27407703 1.00 HIF1A (0.57) HIF1AALDH1A1LMNAHPGDFOLH1
SCHEMBL30007831 0.88 HIF1A (0.60) HIF1AALDH1A1LMNAHPGDTSHR
SCHEMBL29391748 0.88 HIF1A (0.60) HIF1AALDH1A1LMNAHPGDTSHR
SCHEMBL6703043 0.88 HIF1A (0.60) HIF1AALDH1A1LMNAHPGDTSHR
SCHEMBL3621281 0.88 HIF1A (0.60) HIF1AALDH1A1LMNAHPGDTSHR
SCHEMBL3621278 0.88 HIF1A (0.60) HIF1AALDH1A1LMNAHPGDTSHR
SCHEMBL27494874 0.88 HIF1A (0.46) HIF1AALDH1A1LMNATSHRPOLB
SCHEMBL27463792 0.86 HIF1A (0.44) HIF1AALDH1A1LMNAHPGDFOLH1
SCHEMBL27541830 0.86 HIF1A (0.43) HIF1AALDH1A1LMNAFOLH1TSHR
SCHEMBL27390096 0.86 HIF1A (0.43) HIF1AALDH1A1LMNAFOLH1TSHR

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1111155-C Process for preparation of pesticides BAYER AG (DE) 2003-06-11 CN disclosed
CN-1107049-C Benzyloxy substituted aromatics and their use as fungicides and insecticides DOW BENEFITING AGRICULTURE CO (US) 2003-04-30 CN disclosed
CN-1100761-C Benzyloxy substituted aromatics and their use as fungicides and insecticides DOW YINONG CORP (US) 2003-02-05 CN disclosed
CN-1383424-A Aryl and heteroacrylcyclopropyl oxime ethers and their use as fungicides AMERICAN DOW YNON CORP (US) 2002-12-04 CN disclosed
CN-1092181-C Benzyloxy substitutedaromatics and their use as fungicides and insecticides DOW AGROSCIENCES LLC (US) 2002-10-09 CN disclosed
CN-1203584-A Process for preparation of pesticides NOVARTIS AG (CH) 1998-12-30 CN disclosed
CN-1187810-A New hydroximic acid derivatives RHONE POULENC AGROCHIMIE (FR) 1998-07-15 CN disclosed
CN-1175575-A Benzyloxy substituted aromatics and their use as fungicides and insecticides ROHM & HAAS (US) 1998-03-11 CN disclosed
CN-1171392-A Benzyloxy substitutedaromatics and their use as fungicides and insecticides ROHM & HAAS (US) 1998-01-28 CN disclosed