SCHEMBL7628748

SCHEMBL7628748

O=C(Cl)CCC1C(=O)OCN1C(=O)OCc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.61
PSEN1 P49768 1/20 0.46
PSEN2 P49810 1/20 0.46
APH1B Q8WW43 1/20 0.46
NCSTN Q92542 1/20 0.46
APH1A Q96BI3 1/20 0.46
PSENEN Q9NZ42 1/20 0.46
HTR2C P28335 1/20 0.43
F2 P00734 2/20 0.42
ELANE P08246 2/20 0.42
CTSG P08311 1/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
ALDH1A1 P00352 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
PREP P48147 1/20 0.40

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
SCHEMBL5711260 1.00 USP2 (0.61) USP2PSEN1PSEN2APH1BNCSTN
SCHEMBL5711389 1.00 USP2 (0.61) USP2PSEN1PSEN2APH1BNCSTN
SCHEMBL5711176 0.93 USP2 (0.59) USP2PSEN1PSEN2APH1BNCSTN
SCHEMBL5711262 0.93 USP2 (0.59) USP2PSEN1PSEN2APH1BNCSTN
SCHEMBL5711215 0.92 USP2 (0.58) USP2PSEN1PSEN2APH1BNCSTN
SCHEMBL3184957 0.91 USP2 (0.63) USP2PSEN1PSEN2APH1BNCSTN
SCHEMBL5711284 0.91 USP2 (0.63) USP2PSEN1PSEN2APH1BNCSTN
SCHEMBL5711299 0.91 USP2 (0.63) USP2PSEN1PSEN2APH1BNCSTN
SCHEMBL8013209 0.89 USP2 (0.65) USP2PSEN1PSEN2APH1BNCSTN
SCHEMBL8418323 0.89 USP2 (0.59) USP2PSEN1PSEN2APH1BNCSTN

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
US-6458337-B1 Diagnostic imaging contrast agent with improved in serum relaxivity DIBRA S.P.A (IT) 2002-10-01 US disclosed
EP-0920411-A1 DIAGNOSTIC IMAGING CONTRAST AGENT WITH IMPROVED IN-SERUM-RELAXIVITY BRACCO S.p.A. (IT) 1999-06-09 EP disclosed
WO-1998005626-A1 DIAGNOSTIC IMAGING CONTRAST AGENT WITH IMPROVED IN-SERUM-RELAXIVITY BRACCO S.P.A. (IT) 1998-02-12 WO disclosed