SCHEMBL31050899

SCHEMBL31050899

CCCCCCCCCCCCCCCCCCCCCCCNC(=O)c1ccc2c3ccc(C(=O)O)c4c(C(=O)O)ccc(c5ccc(C(N)=O)c1c52)c43

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ NAAA Q02083 4/20 0.48
▸ ALDH1A1 P00352 3/20 0.46
▸ LMNA P02545 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ ALOX15 P16050 3/20 0.45
▸ ALOX5 P09917 2/20 0.44
▸ HTT P42858 2/20 0.44
▸ TSHR P16473 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ HPGD P15428 2/20 0.43
▸ CA2 P00918 1/20 0.42
▸ MLYCD O95822 1/20 0.40
▸ EPHX1 P07099 1/20 0.40

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
SCHEMBL284968 0.94 NAAA (0.54) NAAAALDH1A1LMNASMN1; SMN2ALOX15
SCHEMBL29850750 0.94 NAAA (0.54) NAAAALDH1A1LMNASMN1; SMN2ALOX15
SCHEMBL1270417 0.94 NAAA (0.54) NAAAALDH1A1LMNASMN1; SMN2ALOX15
SCHEMBL30194975 0.94 NAAA (0.54) NAAAALDH1A1LMNASMN1; SMN2ALOX15
SCHEMBL14823376 0.94 NAAA (0.54) NAAAALDH1A1LMNASMN1; SMN2ALOX15
SCHEMBL418872 0.94 NAAA (0.54) NAAAALDH1A1LMNASMN1; SMN2ALOX15
SCHEMBL30875601 0.92 TSHR (0.51) NAAAALDH1A1LMNASMN1; SMN2ALOX15
SCHEMBL2671340 0.92 TSHR (0.51) NAAAALDH1A1LMNASMN1; SMN2ALOX15
SCHEMBL10892084 0.92 TSHR (0.51) NAAAALDH1A1LMNASMN1; SMN2ALOX15
SCHEMBL30875593 0.88 HTT (0.57) NAAAALDH1A1LMNASMN1; SMN2ALOX15

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-114907373-B Conjugated organic small molecular material and preparation method and application thereof 深圳先进电子材料国际创新研究院 2024-08-20 — — CN disclosed
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