SCHEMBL20144313

SCHEMBL20144313

CCSCc1cccnc1C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.58
MAPT P10636 2/20 0.58
CYP1A2 P05177 2/20 0.58
ALDH1A1 P00352 6/20 0.47
L3MBTL1 Q9Y468 3/20 0.47
ALOX15 P16050 2/20 0.47
TSHR P16473 2/20 0.47
CYP3A4 P08684 1/20 0.47
BLM P54132 1/20 0.47
AGER Q15109 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
GAA P10253 2/20 0.43
MYC P01106 1/20 0.43
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
LMNA P02545 1/20 0.38
NAPRT Q6XQN6 1/20 0.38
P4HTM Q9NXG6 1/20 0.38
CYP2C9 P11712 1/20 0.38
TP53 P04637 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
SCHEMBL353589 0.83 KDM4E (0.70) KDM4EMAPTCYP1A2ALDH1A1L3MBTL1
Benzene SCHEMBL11818131 0.83 KDM4E (0.70) KDM4EMAPTCYP1A2ALDH1A1L3MBTL1
Hydrochloric Acid SCHEMBL17746085 0.81 KDM4E (0.68) KDM4EMAPTCYP1A2ALDH1A1L3MBTL1
Acetic Acid SCHEMBL16667162 0.80 KDM4E (0.66) KDM4EMAPTCYP1A2ALDH1A1L3MBTL1
SCHEMBL22653038 0.78 KDM4E (0.64) KDM4EMAPTCYP1A2ALDH1A1L3MBTL1
SCHEMBL27231741 0.77 KDM4E (0.72) KDM4EMAPTCYP1A2ALDH1A1L3MBTL1
SCHEMBL9957114 0.77 KDM4E (0.50) KDM4EMAPTCYP1A2ALDH1A1L3MBTL1
SCHEMBL990359 0.75 KDM4E (0.70) KDM4EMAPTCYP1A2ALDH1A1L3MBTL1
SCHEMBL9295028 0.75 KDM4E (0.60) KDM4EMAPTCYP1A2ALDH1A1L3MBTL1
SCHEMBL5498415 0.74 KDM4E (0.58) KDM4EMAPTCYP1A2ALDH1A1L3MBTL1

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-112021322-B Compositions and methods for controlling pests 住友化学株式会社 2022-04-01 CN disclosed
CN-112021322-A Compositions and methods for controlling pests 住友化学株式会社 2020-12-04 CN disclosed
EP-2938601-B1 FUSED OXAZOLE COMPOUNDS AND USE THEREOF FOR PEST CONTROL SUMITOMO CHEMICAL CO (JP) 2018-05-16 EP disclosed