SCHEMBL28707697

SCHEMBL28707697

COc1ccc2c(c1)N(Cc1ccccc1)CCN2C(=O)Nc1ccc(C)cc1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ FAAH O00519 8/20 0.49
▸ SMN1; SMN2 Q16637 3/20 0.48
▸ NPC1 O15118 2/20 0.48
▸ NFKB1 P19838 2/20 0.48
▸ RAB9A P51151 2/20 0.48
▸ NFKB2 Q00653 2/20 0.48
▸ RELA Q04206 2/20 0.48
▸ MAPT P10636 2/20 0.48
▸ PKM P14618 1/20 0.48
▸ MAOB P27338 1/20 0.48
▸ TP53 P04637 1/20 0.47
▸ BRD4 O60885 2/20 0.47
▸ MEN1 O00255 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ CACNA1G O43497 2/20 0.45
▸ CACNA1H O95180 2/20 0.45
▸ CACNA1I Q9P0X4 2/20 0.45
▸ LMNA P02545 1/20 0.45

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
SCHEMBL28707698 0.95 MAPT (0.54) FAAHSMN1; SMN2NPC1NFKB1RAB9A
SCHEMBL28715966 0.89 ALDH1A1 (0.55) FAAHSMN1; SMN2NPC1RAB9AMAPT
SCHEMBL28718272 0.88 ACHE (0.48) FAAHSMN1; SMN2NPC1NFKB1RAB9A
SCHEMBL29670963 0.88 HDAC1 (0.50) FAAHSMN1; SMN2NPC1NFKB1RAB9A
SCHEMBL28715967 0.88 HDAC1 (0.50) FAAHSMN1; SMN2NPC1NFKB1RAB9A
SCHEMBL29670962 0.88 ALDH1A1 (0.58) FAAHSMN1; SMN2NPC1NFKB1RAB9A
SCHEMBL28714009 0.88 ALDH1A1 (0.58) FAAHSMN1; SMN2NPC1NFKB1RAB9A
SCHEMBL28705611 0.86 HDAC1 (0.50) FAAHSMN1; SMN2NPC1NFKB1RAB9A
SCHEMBL29670989 0.86 HDAC1 (0.50) FAAHSMN1; SMN2NPC1NFKB1RAB9A
SCHEMBL28718309 0.86 BRD4 (0.47) SMN1; SMN2MAPTBRD4MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114276303-B Ureido compounds or pharmaceutically acceptable salts thereof, and preparation method and application thereof 河南大学 2023-09-22 — — CN disclosed
CN-114276303-A Ureido compound or its medicinal salt and its preparing process and application 河南大学 2022-04-05 — — CN disclosed
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