SCHEMBL14747435

SCHEMBL14747435

Cc1ccc2c(c1)C(C)(C)/C(=C\C=C\c1sc3cc(S(=O)(=O)N4CCCCC4)ccc3[n+]1C)N2CCCCCC(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.38
▸ MAPK1 P28482 2/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ MAPT P10636 6/20 0.37
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ PTPN1 P18031 1/20 0.36
▸ TP53 P04637 1/20 0.35
▸ THRB P10828 1/20 0.35
▸ HRH2 P25021 6/20 0.35
▸ UBE2N P61088 1/20 0.34
▸ CXCR4 P61073 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ USP2 O75604 1/20 0.34
▸ MTOR P42345 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ FOLH1 Q04609 1/20 0.34

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
SCHEMBL1105638 0.94 MAPT (0.39) LMNAMAPK1SMN1; SMN2ALDH1A1HTT
SCHEMBL14747443 0.89 PTPN1 (0.43) LMNAMAPK1SMN1; SMN2ALDH1A1HTT
SCHEMBL14747444 0.87 PTPN1 (0.41) MAPTPTPN1HRH2CXCR4FOLH1
SCHEMBL14747448 0.85 FOLH1 (0.37) PTPN1HRH2CXCR4NPC1USP2
SCHEMBL1105635 0.84 MAPT (0.36) LMNAMAPK1SMN1; SMN2ALDH1A1HTT
SCHEMBL1105643 0.84 PTPN1 (0.44) LMNAMAPTMEN1KMT2APTPN1
SCHEMBL1105706 0.81 PTPN1 (0.42) MAPTPTPN1HRH2CXCR4FOLH1
SCHEMBL10118448 0.80 CXCR4 (0.39) PTPN1HRH2CXCR4FOLH1
SCHEMBL15827270 0.79 MEN1 (0.41) LMNAMAPK1SMN1; SMN2ALDH1A1HTT
SCHEMBL14747449 0.77 PTPN1 (0.44) PTPN1HRH2NPC1USP2MTOR

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
US-8389729-B2 Methods for detecting the presence, location or quantity of targets using novel dyes ENZO LIFE SCIENCES, INC. (US) 2013-03-05 — — US disclosed
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