SCHEMBL28794160

SCHEMBL28794160

Cc1ccc(-c2ncc(-c3nc4ccccc4o3)n2CC(=O)O)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ P2RY14 Q15391 1/20 0.43
▸ HSD17B10 Q99714 6/20 0.43
▸ MAPT P10636 5/20 0.43
▸ SMN1; SMN2 Q16637 4/20 0.43
▸ KDM4E B2RXH2 3/20 0.43
▸ RXFP1 Q9HBX9 2/20 0.43
▸ PTPN2 P17706 1/20 0.43
▸ PTPN1 P18031 1/20 0.43
▸ PTPN5 P54829 1/20 0.43
▸ TP53 P04637 2/20 0.42
▸ MEN1 O00255 2/20 0.42
▸ ALOX15 P16050 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ THRB P10828 1/20 0.42
▸ NPC1 O15118 5/20 0.42
▸ RAB9A P51151 5/20 0.42
▸ ALDH1A1 P00352 3/20 0.42
▸ HPGD P15428 3/20 0.42
▸ CEPT1 Q9Y6K0 1/20 0.41
▸ POLB P06746 2/20 0.41

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
SCHEMBL27848305 0.85 NPC1 (0.44) P2RY14HSD17B10MAPTSMN1; SMN2KDM4E
SCHEMBL27848319 0.84 MEN1 (0.48) HSD17B10MAPTSMN1; SMN2KDM4ETP53
SCHEMBL27865414 0.84 MET (0.43) P2RY14HSD17B10MAPTSMN1; SMN2KDM4E
SCHEMBL27848415 0.82 PPARG (0.43) P2RY14HSD17B10MAPTSMN1; SMN2KDM4E
Hydrochloric Acid SCHEMBL27865341 0.81 NPC1 (0.44) HSD17B10MAPTSMN1; SMN2KDM4EPTPN2
SCHEMBL27848324 0.80 HPGD (0.44) HSD17B10MAPTSMN1; SMN2KDM4EPTPN2
SCHEMBL27848329 0.80 P2RY14 (0.42) P2RY14MAPTSMN1; SMN2RXFP1TP53
SCHEMBL27865345 0.78 MAPT (0.56) P2RY14HSD17B10MAPTSMN1; SMN2KDM4E
SCHEMBL27865326 0.77 DUSP1 (0.39) P2RY14HSD17B10MAPTSMN1; SMN2KDM4E
SCHEMBL27865377 0.76 PTPN2 (0.42) HSD17B10MAPTSMN1; SMN2KDM4EPTPN2

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-102428080-A Therapeutic or prophylactic agent for diseases in which neurotrophic factor activity participates SUMITOMO CHEMICAL CO 2012-04-25 — — CN disclosed
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