SCHEMBL27499691

SCHEMBL27499691

CCN1c2ccccc2OCC1C=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.40
▸ KMT2A Q03164 5/20 0.40
▸ NPSR1 Q6W5P4 2/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ MEN1 O00255 4/20 0.39
▸ LMNA P02545 2/20 0.39
▸ POLB P06746 2/20 0.38
▸ ESR2 Q92731 1/20 0.38
▸ NISCH Q9Y2I1 1/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ TP53 P04637 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ CRHBP P24387 1/20 0.38
▸ CRHR2 Q13324 1/20 0.38
▸ GAA P10253 1/20 0.37
▸ CYP1A2 P05177 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ CYP2D6 P10635 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
SCHEMBL27312472 0.81 SMN1; SMN2 (0.42) SMN1; SMN2KMT2ANPSR1L3MBTL1ALDH1A1
SCHEMBL27301133 0.81 SMN1; SMN2 (0.36) SMN1; SMN2KMT2ANPSR1L3MBTL1ALDH1A1
SCHEMBL11007300 0.79 SMN1; SMN2 (0.50) SMN1; SMN2KMT2AALDH1A1MEN1LMNA
SCHEMBL27528752 0.79 ALDH1A1 (0.35) SMN1; SMN2KMT2ANPSR1ALDH1A1MEN1
SCHEMBL12343889 0.76 L3MBTL1 (0.45) SMN1; SMN2KMT2ANPSR1L3MBTL1ALDH1A1
SCHEMBL7766488 0.76 HTT (0.35) KMT2AL3MBTL1ALDH1A1POLBESR2
SCHEMBL27517106 0.75 SMN1; SMN2 (0.41) SMN1; SMN2KMT2ANPSR1ALDH1A1MEN1
SCHEMBL27520107 0.75 SMN1; SMN2 (0.38) SMN1; SMN2KMT2ANPSR1L3MBTL1ALDH1A1
SCHEMBL11217085 0.75 LMNA (0.53) SMN1; SMN2KMT2ANPSR1ALDH1A1LMNA
SCHEMBL25561822 0.74 PIK3CD (0.41) L3MBTL1GAA

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-1215595-C Nonaqueous electrolyte and secondary battery using the same MITSUBISHI CHEM CORP (JP) 2005-08-17 — — CN disclosed
CN-1465117-A Nonaqueous electrolyte and secondary battery using the same MITSUBISHI CHEM CORP (JP) 2003-12-31 — — CN disclosed
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