SCHEMBL11613680

SCHEMBL11613680

O=C(O)CNc1ncco1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 2/20 0.39
▸ TP53 P04637 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.37
▸ FFAR2 O15552 1/20 0.36
▸ LRRK2 Q5S007 1/20 0.36
▸ CSNK2A2 P19784 1/20 0.35
▸ CSNK2B P67870 1/20 0.35
▸ CSNK2A1 P68400 1/20 0.35
▸ CSNK2A3 Q8NEV1 1/20 0.35
▸ CES1 P23141 3/20 0.33
▸ EGLN2 Q96KS0 1/20 0.33
▸ FTO Q9C0B1 1/20 0.33
▸ NAMPT P43490 1/20 0.33
▸ PSMD14 O00487 1/20 0.33
▸ STAMBP O95630 1/20 0.33
▸ COPS5 Q92905 1/20 0.33
▸ FAAH O00519 3/20 0.33
▸ NCEH1 Q6PIU2 1/20 0.33
▸ EGLN1 Q9GZT9 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
Hydrochloric Acid SCHEMBL14744482 0.74 KDM4E (0.33) EPHX2TP53RAB9AKDM4EFFAR2
SCHEMBL3070030 0.74 — —
SCHEMBL11278949 0.72 — —
SCHEMBL4587820 0.71 — —
SCHEMBL4722379 0.71 — —
Acetic Acid SCHEMBL27503512 0.71 FFAR2 (0.40) EPHX2FFAR2LRRK2CSNK2A2CSNK2B
SCHEMBL20024590 0.70 NR4A2 (0.43) CES1EGLN2FTOFAAHNCEH1
SCHEMBL14679053 0.70 PRMT1 (0.49) NAMPT
SCHEMBL25076265 0.69 EPHX2 (0.37) EPHX2RAB9AFFAR2NAMPTFAAH
SCHEMBL3262436 0.68 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114478425-B Synthetic method of aryloxy phenoxy propionate herbicide 安徽宁亿泰科技有限公司 2024-03-22 — — CN disclosed
CN-114478425-A Synthetic method of aryloxy phenoxy propionate herbicide 安徽宁亿泰科技有限公司 2022-05-13 — — CN disclosed
CN-86101382-A Prepare the method for β-Nei Xiananleikangshengsu and the application in medicine thereof — 1986-09-03 — — CN disclosed
US-4088816-A BACTERICIDES E. R. SQUIBB & SONS, INC. (US) 1978-05-09 — — US disclosed
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