SCHEMBL27479697

SCHEMBL27479697

Cc1ccccc1NC(=O)C=O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 3/20 0.64
▸ RAB9A P51151 3/20 0.64
▸ HPGD P15428 5/20 0.62
▸ ALDH1A1 P00352 3/20 0.62
▸ MMP1 P03956 4/20 0.62
▸ MMP2 P08253 4/20 0.62
▸ MMP9 P14780 4/20 0.62
▸ EGFR P00533 1/20 0.62
▸ POLB P06746 2/20 0.56
▸ SMN1; SMN2 Q16637 1/20 0.54
▸ ALOX12 P18054 1/20 0.53
▸ PDK1 Q15118 1/20 0.53
▸ PDK2 Q15119 1/20 0.53
▸ PDK3 Q15120 1/20 0.53
▸ PDK4 Q16654 1/20 0.53
▸ GAA P10253 1/20 0.53
▸ MAPT P10636 1/20 0.53
▸ EPHX1 P07099 1/20 0.51
▸ KDM4E B2RXH2 1/20 0.51
▸ LMNA P02545 1/20 0.51

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
SCHEMBL9712813 0.86 NPC1 (0.67) NPC1RAB9AHPGDALDH1A1MMP1
SCHEMBL9411752 0.83 MAPT (0.49) NPC1RAB9AHPGDALDH1A1MMP1
SCHEMBL648951 0.82 NPC1 (0.62) NPC1RAB9AHPGDALDH1A1MMP1
SCHEMBL26640096 0.82 NPC1 (0.62) NPC1RAB9AHPGDALDH1A1MMP1
SCHEMBL23306418 0.81 MMP1 (0.68) NPC1RAB9AHPGDALDH1A1MMP1
SCHEMBL5766105 0.81 HPGD (0.63) NPC1RAB9AHPGDALDH1A1MMP1
SCHEMBL7622295 0.81 MMP1 (0.68) NPC1RAB9AHPGDALDH1A1MMP1
SCHEMBL7622299 0.81 MMP1 (0.68) NPC1RAB9AHPGDALDH1A1MMP1
SCHEMBL7434954 0.80 MAPT (0.42) NPC1RAB9AHPGDALDH1A1MMP1
SCHEMBL28909391 0.80 MAPK1 (0.58) NPC1RAB9AHPGDALDH1A1POLB

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1177343-A Cell adhesion inhibitors BIOGEN INC (US) 1998-03-25 — — CN claimed
CN-116547266-A Synthesis method of anthranilic acid/amide compound and intermediate thereof 皮埃企业有限公司 2023-08-04 — — CN disclosed
CN-1177343-A Cell adhesion inhibitors BIOGEN INC (US) 1998-03-25 — — CN disclosed
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