SCHEMBL30977281

SCHEMBL30977281

Sc1ccccc1-c1c(Cl)cccc1Cl

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.41
▸ TSHR P16473 2/20 0.41
▸ CYP2A6 P11509 3/20 0.41
▸ ADORA2A P29274 1/20 0.39
▸ PDK2 Q15119 1/20 0.39
▸ IDO1 P14902 3/20 0.37
▸ DNMT1 P26358 1/20 0.37
▸ DNMT3L Q9UJW3 1/20 0.37
▸ DNMT3A Q9Y6K1 1/20 0.37
▸ NSD2 O96028 1/20 0.36
▸ BCHE P06276 1/20 0.36
▸ DAO P14920 1/20 0.36
▸ CES1 P23141 1/20 0.36
▸ CYP1A2 P05177 2/20 0.36
▸ NPC1 O15118 2/20 0.35
▸ RAB9A P51151 2/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ TP53 P04637 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ PTPRC P08575 1/20 0.35

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
SCHEMBL28947602 0.86 CYP1A1 (0.41) LMNACYP2A6ADORA2APDK2CYP1A2
SCHEMBL942740 0.80 CYP2A6 (0.50) LMNATSHRCYP2A6IDO1DNMT1
SCHEMBL2469822 0.79 CYP2A6 (0.55) LMNATSHRCYP2A6ADORA2APDK2
SCHEMBL9162940 0.79 NUDT1 (0.41) LMNATSHRCYP2A6IDO1CYP1A2
SCHEMBL30529448 0.79 NUDT1 (0.41) LMNATSHRCYP2A6IDO1CYP1A2
SCHEMBL38650555 0.79 CYP1A1 (0.42) LMNATSHRADORA2ANSD2CYP1A2
SCHEMBL31037155 0.78 S100A4 (0.54) LMNACYP1A2SMN1; SMN2TP53HPGD
SCHEMBL29145045 0.78 CYP2A6 (0.48) LMNATSHRCYP2A6IDO1DNMT1
SCHEMBL30308400 0.76 KMO (0.41) LMNATSHRCYP2A6PDK2IDO1
SCHEMBL28364118 0.74 CYP2A6 (0.44) LMNATSHRCYP2A6CYP1A2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115611868-B Furanamide derivative and preparation method and application thereof 山东大学 2024-07-23 — — CN disclosed
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