SCHEMBL30451840

SCHEMBL30451840

Cc1cccc2cc(Oc3cccc(F)c3C(C)(C)O)cnc12

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ EGLN1 Q9GZT9 1/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ GCK P35557 3/20 0.32
▸ NR1H3 Q13133 2/20 0.32
▸ NR1H2 P55055 1/20 0.32
▸ PIK3CD O00329 1/20 0.32
▸ MAP4K1 Q92918 1/20 0.32
▸ HPGDS O60760 2/20 0.32
▸ CYP11B1 P15538 1/20 0.32
▸ CYP11B2 P19099 1/20 0.32
▸ TNF P01375 2/20 0.31
▸ PIN1 Q13526 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ NPC1 O15118 1/20 0.30
▸ RAB9A P51151 1/20 0.30

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
SCHEMBL12487949 0.92 EGLN1 (0.34) EGLN1KDM4EGCKHPGDSCYP11B1
SCHEMBL12489724 0.86 EGLN1 (0.37) EGLN1KDM4EGCKCYP11B1CYP11B2
SCHEMBL29138802 0.85 KDM4E (0.37) EGLN1KDM4EGCKHPGDSCYP11B1
SCHEMBL20577271 0.83 GCK (0.36) EGLN1GCKCYP11B1CYP11B2TNF
SCHEMBL12489581 0.82 EGLN1 (0.35) EGLN1KDM4EGCKHPGDSCYP11B1
SCHEMBL29777482 0.82 EGLN1 (0.35) EGLN1KDM4EGCKHPGDSCYP11B1
SCHEMBL13684923 0.81 EGLN1 (0.33) EGLN1KDM4ENR1H3HPGDSCYP11B1
SCHEMBL20506407 0.80 MAOB (0.39) EGLN1TNF
SCHEMBL20551081 0.79 SLC6A2 (0.39) KDM4EMAP4K1HPGDSNPC1RAB9A
SCHEMBL12488150 0.76 ALDH1A1 (0.33) KDM4EGCKCYP11B1CYP11B2MAPT

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-111406055-B Microbiocidal thiazole derivatives 先正达参股股份有限公司 2023-09-22 — — CN disclosed
CN-110382492-B Microbiocidal oxadiazole derivatives 先正达参股股份有限公司 2023-07-14 — — CN disclosed
CN-111344279-B Microbiocidal picolinamide derivatives 先正达参股股份有限公司 2023-07-07 — — CN disclosed
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