SCHEMBL30396289

SCHEMBL30396289

CCCCCCCCSc1nc(SCCCCCCCC)nc(-c2ccc(C(C)(C)C)c(O)c2C(C)(C)C)n1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 2/20 0.40
▸ CCNE1 P24864 2/20 0.34
▸ CDK2 P24941 2/20 0.34
▸ SMN1; SMN2 Q16637 3/20 0.34
▸ LMNA P02545 2/20 0.34
▸ MAPT P10636 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ GPR84 Q9NQS5 6/20 0.33
▸ PTGES O14684 2/20 0.33
▸ NPC1 O15118 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ ALPL P05186 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ KMT2A Q03164 1/20 0.32

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
SCHEMBL8412961 0.83 SMN1; SMN2 (0.37) PPARGCCNE1CDK2SMN1; SMN2LMNA
SCHEMBL29683967 0.81 PPARG (0.36) PPARGCCNE1CDK2SMN1; SMN2LMNA
SCHEMBL30428363 0.81 PPARG (0.36) PPARGCCNE1CDK2SMN1; SMN2LMNA
SCHEMBL31707404 0.81 PPARG (0.36) PPARGCCNE1CDK2SMN1; SMN2LMNA
SCHEMBL1081302 0.78 HSP90AA1 (0.42) PPARGSMN1; SMN2LMNAMAPTALDH1A1
SCHEMBL11871791 0.78 PTGS2 (0.45) GPR84
SCHEMBL11870390 0.78 PTGS2 (0.45) GPR84
SCHEMBL11876429 0.78 PTGS2 (0.45) GPR84
SCHEMBL11868877 0.78 PTGS2 (0.45) GPR84
SCHEMBL16196394 0.76 GAA (0.33) PPARGSMN1; SMN2LMNAMAPTALDH1A1

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-115991925-A Cross-linked halogen-free flame-retardant TPE material and preparation method thereof 道恩高材(北京)科技有限公司 2023-04-21 — — CN claimed
CN-115991925-A Cross-linked halogen-free flame-retardant TPE material and preparation method thereof 道恩高材(北京)科技有限公司 2023-04-21 — — CN disclosed
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