SCHEMBL5313526

SCHEMBL5313526

Cc1ccc(-c2ccc(-c3cc(C(N)c4cccs4)n(C)n3)cc2)cc1C

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ NOTUM Q6P988 1/20 0.34
▸ MEN1 O00255 3/20 0.33
▸ KMT2A Q03164 3/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ MAPT P10636 5/20 0.32
▸ LMNA P02545 3/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ ESRRA P11474 1/20 0.32
▸ DCTPP1 Q9H773 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ USP2 O75604 1/20 0.31
▸ BACE1 P56817 1/20 0.31
▸ POLB P06746 1/20 0.30
▸ SLC6A9 P48067 1/20 0.30

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
SCHEMBL5306910 0.80 ESRRA (0.36) MAPTKDM4EGAAESRRADCTPP1
SCHEMBL5308125 0.72 ESRRA (0.43) ALDH1A1MAPTKDM4EGAASMN1; SMN2
SCHEMBL5306918 0.71 MAPT (0.46) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL5313528 0.69 ALDH1A1 (0.45) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL5306577 0.66 CYP11B1 (0.41) MEN1KMT2AALDH1A1MAPTKDM4E
SCHEMBL5306582 0.65 MAPT (0.41) MAPTLMNASMN1; SMN2ESRRAUSP2
SCHEMBL5306917 0.64 PHGDH (0.43) MAPTESRRA
SCHEMBL5326935 0.64 POLB (0.35) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL5338160 0.64 CYP2C19 (0.32) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL4739693 0.63 TOP1 (0.37) MAPTSMN1; SMN2

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
WO-2007034279-A2 C3A ANTAGONISTS AND PHARMACEUTICAL COMPOSITIONS THEREOF PFIZER PRODUCTS INC. (US) 2007-03-29 — — WO claimed
WO-2007034279-A2 C3A ANTAGONISTS AND PHARMACEUTICAL COMPOSITIONS THEREOF PFIZER PRODUCTS INC. (US) 2007-03-29 — — WO disclosed
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