SCHEMBL27918216

SCHEMBL27918216

COCCOc1ccc(C(=O)Nc2ccc(OCc3ccccc3)cc2)c(O)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 9/20 0.62
▸ RAB9A P51151 8/20 0.62
▸ SMN1; SMN2 Q16637 5/20 0.62
▸ ALDH1A1 P00352 2/20 0.62
▸ MAPT P10636 2/20 0.62
▸ PKM P14618 1/20 0.62
▸ MAOB P27338 1/20 0.62
▸ GPR55 Q9Y2T6 1/20 0.58
▸ KLKB1 P03952 2/20 0.56
▸ MEN1 O00255 5/20 0.55
▸ KMT2A Q03164 5/20 0.55
▸ KDM4E B2RXH2 1/20 0.53
▸ LMNA P02545 1/20 0.53
▸ TP53 P04637 1/20 0.53
▸ HTT P42858 1/20 0.53
▸ POLB P06746 1/20 0.53
▸ MAPK1 P28482 1/20 0.53
▸ APOBEC3A P31941 1/20 0.53
▸ APOBEC3G Q9HC16 1/20 0.53
▸ MET P08581 2/20 0.53

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
SCHEMBL27918218 0.91 KLKB1 (0.56) NPC1RAB9ASMN1; SMN2MAPTMAOB
SCHEMBL27936605 0.88 MAOB (0.65) NPC1RAB9ASMN1; SMN2ALDH1A1MAPT
SCHEMBL27918087 0.88 MAOB (0.65) NPC1RAB9ASMN1; SMN2ALDH1A1MAPT
SCHEMBL27936544 0.86 MAPT (0.60) NPC1RAB9AALDH1A1MAPTPKM
SCHEMBL27936581 0.84 KLKB1 (0.78) KLKB1MET
SCHEMBL11690669 0.82 NPC1 (0.73) NPC1RAB9ASMN1; SMN2ALDH1A1MAPT
SCHEMBL27936600 0.81 APP (0.53) ALDH1A1MAOBMEN1KMT2ATP53
SCHEMBL8062716 0.80 MAOB (0.69) MAOBMEN1KMT2ALMNA
SCHEMBL10132123 0.79 MEN1 (0.69) NPC1RAB9ASMN1; SMN2ALDH1A1MAPT
SCHEMBL3214018 0.78 MAOB (0.63) NPC1RAB9ASMN1; SMN2MAPTMAOB

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-103304438-A N-substituted salicylamide type compound as well as preparation method and application thereof UNIV SHANDONG 2013-09-18 — — CN claimed
CN-103304438-B N-substituted salicylamide compounds, preparation method and application SHANDONG UNIVERSITY (CN) 2015-12-02 — — CN disclosed
CN-103304438-A N-substituted salicylamide type compound as well as preparation method and application thereof UNIV SHANDONG 2013-09-18 — — CN disclosed
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