SCHEMBL9850155

SCHEMBL9850155

CCCCCCCCCCCCCCCCc1cnc(-c2ccc(CCCCCCCC)cc2)nc1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.79
▸ RAB9A P51151 4/20 0.79
▸ SMN1; SMN2 Q16637 3/20 0.79
▸ ALDH1A1 P00352 3/20 0.79
▸ HSD17B10 Q99714 3/20 0.79
▸ MEN1 O00255 2/20 0.79
▸ KMT2A Q03164 2/20 0.79
▸ KDM4E B2RXH2 2/20 0.79
▸ USP2 O75604 1/20 0.79
▸ GAA P10253 1/20 0.79
▸ HPGD P15428 1/20 0.79
▸ RARB P10826 6/20 0.72
▸ NPC1 O15118 2/20 0.56
▸ STAT3 P40763 1/20 0.56
▸ ATM Q13315 1/20 0.56
▸ RARA P10276 1/20 0.54
▸ MTOR P42345 1/20 0.54
▸ NFKB1 P19838 1/20 0.52
▸ NFKB2 Q00653 1/20 0.52
▸ RELA Q04206 1/20 0.52

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
SCHEMBL9403673 1.00 MAPT (0.79) MAPTRAB9ASMN1; SMN2ALDH1A1HSD17B10
SCHEMBL10346231 1.00 MAPT (0.79) MAPTRAB9ASMN1; SMN2ALDH1A1HSD17B10
SCHEMBL9723153 1.00 MAPT (0.79) MAPTRAB9ASMN1; SMN2ALDH1A1HSD17B10
SCHEMBL10482122 1.00 MAPT (0.79) MAPTRAB9ASMN1; SMN2ALDH1A1HSD17B10
SCHEMBL9850179 1.00 MAPT (0.79) MAPTRAB9ASMN1; SMN2ALDH1A1HSD17B10
SCHEMBL9850118 1.00 MAPT (0.79) MAPTRAB9ASMN1; SMN2ALDH1A1HSD17B10
SCHEMBL9850122 1.00 MAPT (0.79) MAPTRAB9ASMN1; SMN2ALDH1A1HSD17B10
SCHEMBL9850258 1.00 MAPT (0.79) MAPTRAB9ASMN1; SMN2ALDH1A1HSD17B10
SCHEMBL9850312 1.00 MAPT (0.79) MAPTRAB9ASMN1; SMN2ALDH1A1HSD17B10
SCHEMBL9850137 1.00 MAPT (0.79) MAPTRAB9ASMN1; SMN2ALDH1A1HSD17B10

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
EP-0454157-A1 Alkylphenylalkylpyrimidine compound and liquid crystal composition containing the same Chisso Corporation (JP) 1991-10-30 — — EP claimed
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