SCHEMBL7368461

SCHEMBL7368461

CCC1(CC)C(=O)NC1Oc1ccc(C(C)=O)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ MAPT P10636 3/20 0.42
▸ HPGD P15428 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ POLB P06746 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ MAOB P27338 5/20 0.37
▸ MMP2 P08253 1/20 0.37
▸ MMP9 P14780 1/20 0.37
▸ MMP8 P22894 1/20 0.37
▸ HRH3 Q9Y5N1 3/20 0.36
▸ STS P08842 1/20 0.36
▸ CYP2C9 P11712 2/20 0.36
▸ CYP2C19 P33261 2/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ PPARG P37231 1/20 0.36
▸ PPARA Q07869 1/20 0.36

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
SCHEMBL7372508 1.00 LMNA (0.43) LMNASMN1; SMN2MAPTHPGDRAB9A
SCHEMBL8605725 0.89 ELANE (0.41) LMNAALDH1A1KMT2A
SCHEMBL8605131 0.89 ELANE (0.41) LMNAALDH1A1KMT2A
SCHEMBL7371447 0.83 CA12 (0.36) POLBMMP2MMP9MMP8CYP2C19
SCHEMBL7434188 0.81 ELANE (0.43) LMNAHPGDGAAPOLBALDH1A1
SCHEMBL7429786 0.81 ELANE (0.43) LMNAHPGDGAAPOLBALDH1A1
SCHEMBL7368613 0.80 NPC1 (0.35) LMNAMAPTRAB9AL3MBTL1MMP2
SCHEMBL3036136 0.79 KMT2A (0.49) LMNASMN1; SMN2MAPTHPGDRAB9A
SCHEMBL7977845 0.79 NPC1 (0.49) HPGDL3MBTL1GAAPOLBHRH3
SCHEMBL9580715 0.74 TSHR (0.41) LMNASMN1; SMN2MAPTGAAPOLB

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
WO-1994010143-A1 NEW SUBSTITUTED AZETIDINONES AS ANTI-INFLAMMATORY AND ANTIDEGENERATIVE AGENTS MERCK & CO., INC. (US) 1994-05-11 — — WO disclosed
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