SCHEMBL9737713

SCHEMBL9737713

NC(=O)c1c(I)c(OCC(=O)NCCO)c(I)c(C(=O)N(CC(O)CO)CC(O)CO)c1I

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.38
RAB9A P51151 1/20 0.34
CYP2C19 P33261 1/20 0.33
HIF1A Q16665 1/20 0.33
ALDH1A1 P00352 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
SCHEMBL9735189 0.90 LMNA (0.45) LMNACYP2C19HIF1A
SCHEMBL9735879 0.87 LMNA (0.39) LMNACYP2C19HIF1A
SCHEMBL9293485 0.82 LMNA (0.44) LMNARAB9ACYP2C19HIF1AALDH1A1
SCHEMBL8858996 0.77 LMNA (0.47) LMNARAB9ACYP2C19HIF1AALDH1A1
SCHEMBL5162293 0.76 LMNA (0.47) LMNACYP2C19HIF1A
SCHEMBL29665118 0.74 CYP2C19 (0.36) LMNACYP2C19HIF1A
SCHEMBL8720205 0.74 CYP2C19 (0.36) LMNACYP2C19HIF1A
SCHEMBL7056057 0.74 CYP2C19 (0.36) LMNACYP2C19HIF1A
SCHEMBL5033195 0.74 LMNA (0.45) LMNACYP2C19HIF1A
SCHEMBL7607980 0.73 LMNA (0.47) LMNACYP2C19HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0365541-B1 PREPARATION OF 5-ACYLAMINO-2,4,6-TRIIODO- OR TRIBROMO-BENZOIC ACID DERIVATIVES BRACCO S.p.A. (IT) 1992-08-12 EP disclosed
US-5066823-A Rearrangement reaction, contrast agent for radiology BRACCO INDUSTRIA CHEMICA S.P.A. (IT) 1991-11-19 US disclosed
EP-0365541-A1 PREPARATION OF 5-ACYLAMINO-2,4,6-TRIIODO- OR TRIBROMO-BENZOIC ACID DERIVATIVES. BRACCO IND CHIMICA SPA (IT) 1990-05-02 EP disclosed
WO-1988009328-A1 PREPARATION OF 5-ACYLAMINO-2,4,6-TRIIODO- OR TRIBROMO-BENZOIC ACID DERIVATIVES BRACCO INDUSTRIA CHIMICA S.P.A. (IT) 1988-12-01 WO disclosed