SCHEMBL29246501

SCHEMBL29246501

C[Si](C)(C)CCOCn1cc(F)c2cc(Oc3cc(F)ccc3C(=O)O)c(Cl)nc21

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ DGAT1 O75907 6/20 0.34
▸ LTB4R Q15722 1/20 0.34
▸ LTB4R2 Q9NPC1 1/20 0.34
▸ KLKB1 P03952 1/20 0.33
▸ PTPN1 P18031 1/20 0.32
▸ EGLN1 Q9GZT9 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ METTL3 Q86U44 1/20 0.31
▸ METTL14 Q9HCE5 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ DHODH Q02127 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
SCHEMBL29246322 0.91 DGAT1 (0.36) DGAT1KMT2ANPC1MAPT
SCHEMBL31019222 0.91 DGAT1 (0.36) DGAT1KMT2ANPC1MAPT
SCHEMBL30421232 0.76 DGAT1 (0.34) DGAT1PTPN1NPC1
SCHEMBL30421153 0.74 DGAT1 (0.39) DGAT1
SCHEMBL30421657 0.71 DGAT1 (0.31) DGAT1
SCHEMBL20455667 0.71 DGAT1 (0.38) DGAT1PTPN1NPC1MAPT
SCHEMBL29659291 0.71 DGAT1 (0.38) DGAT1PTPN1NPC1MAPT
SCHEMBL27741684 0.70 DGAT1 (0.38) DGAT1KLKB1PTPN1MEN1KMT2A
SCHEMBL31748342 0.70 KEAP1 (0.41) DGAT1KLKB1PTPN1NPC1
SCHEMBL21818656 0.69 DGAT1 (0.35) DGAT1KLKB1KMT2ANPC1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118284608-A Compounds as BCL-2 inhibitors 重庆复创医药研究有限公司 2024-07-02 — — CN disclosed
CN-118215661-A Compounds as BCL-2 inhibitors 重庆复创医药研究有限公司 2024-06-18 — — CN disclosed
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