SCHEMBL2265099

SCHEMBL2265099

O=C(CO)OCCC1CCCCC1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.46
EPHX1 P07099 2/20 0.44
LMNA P02545 1/20 0.42
NAAA Q02083 8/20 0.40
NFE2L2 Q16236 1/20 0.40
ASAH1 Q13510 1/20 0.39
HPGD P15428 2/20 0.39
MEN1 O00255 1/20 0.38
MAPT P10636 1/20 0.38
KMT2A Q03164 1/20 0.38
ATM Q13315 1/20 0.38

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
SCHEMBL27979509 0.93 LMNA (0.45) SMN1; SMN2EPHX1LMNANAAANFE2L2
SCHEMBL28322505 0.90 SMN1; SMN2 (0.36) SMN1; SMN2EPHX1NAAAMAPT
SCHEMBL27842415 0.86 EPHX1 (0.49) SMN1; SMN2EPHX1LMNANAAANFE2L2
SCHEMBL6019680 0.84 SMN1; SMN2 (0.46) SMN1; SMN2EPHX1LMNANAAANFE2L2
SCHEMBL1734362 0.83 EPHX1 (0.46) SMN1; SMN2EPHX1LMNANAAAASAH1
SCHEMBL8395728 0.82 SMN1; SMN2 (0.45) SMN1; SMN2EPHX1LMNANAAANFE2L2
SCHEMBL8893833 0.82 SMN1; SMN2 (0.45) SMN1; SMN2EPHX1LMNANAAANFE2L2
SCHEMBL10872593 0.82 SMN1; SMN2 (0.49) SMN1; SMN2EPHX1LMNANAAAASAH1
SCHEMBL8394699 0.82 SMN1; SMN2 (0.45) SMN1; SMN2EPHX1LMNANAAANFE2L2
SCHEMBL16470982 0.82 SMN1; SMN2 (0.49) SMN1; SMN2EPHX1LMNANAAANFE2L2

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
CN-118510877-A Cleaning composition for pretreatment of metal substrates, method for the production thereof and use thereof 巴斯夫涂料有限公司 2024-08-16 CN disclosed
US-8741809-B2 Liquid pyraclostrobin-containing crop protection formulations BASF SE (DE) 2014-06-03 US disclosed
US-20110195846-A1 Liquid Pyraclostrobin-Containing Crop Protection Formulations BASF SE (DE) 2011-08-11 US disclosed