SCHEMBL13409454

SCHEMBL13409454

CC(=O)NCNC(=O)N1CCCCCC1=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.42
SMN1; SMN2 Q16637 3/20 0.40
MITF O75030 1/20 0.40
NPSR1 Q6W5P4 1/20 0.34
KMT2A Q03164 5/20 0.34
ALDH1A1 P00352 4/20 0.34
KDM4E B2RXH2 2/20 0.34
MEN1 O00255 2/20 0.33
MAPT P10636 2/20 0.33
STAT6 P42226 1/20 0.33
ITGB1 P05556 1/20 0.33
ITGA4 P13612 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
THRB P10828 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
RECQL P46063 1/20 0.33
BLM P54132 1/20 0.33
TP53 P04637 1/20 0.33

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
SCHEMBL14308974 0.82 LMNA (0.46) LMNASMN1; SMN2MITFKMT2AALDH1A1
SCHEMBL12326879 0.78 LMNA (0.44) LMNASMN1; SMN2MITFKMT2AALDH1A1
SCHEMBL1374699 0.78 LMNA (0.44) LMNASMN1; SMN2MITFKMT2AALDH1A1
SCHEMBL5019491 0.78 LMNA (0.44) LMNASMN1; SMN2MITFKMT2AALDH1A1
SCHEMBL18012879 0.78 LMNA (0.44) LMNASMN1; SMN2MITFKMT2AALDH1A1
SCHEMBL11816203 0.77 HTT (0.44) LMNASMN1; SMN2MITFNPSR1KMT2A
SCHEMBL13085727 0.76 MITF (0.46) LMNASMN1; SMN2MITFKMT2AALDH1A1
SCHEMBL12599179 0.76 MITF (0.46) LMNASMN1; SMN2MITFKMT2AALDH1A1
SCHEMBL16151989 0.76 KDM4E (0.43) LMNAKDM4E
SCHEMBL16436869 0.75 HTT (0.45) LMNAKMT2AALDH1A1MEN1CYP1A2

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
US-7705088-B2 blocked isocyanate with hydroxy is derived from the reaction between a resorcinol compound and at least two different isocyanate compounds; improved adhesion of reinforcing materials to rubbers; used in fabric dipping formulations INDSPEC CHEMICAL CORPORATION (US) 2010-04-27 US disclosed
US-20070205393-A1 Resorcinol-Blocked Isocyanate Compositions and Their Applications INDSPEC CHEMICAL CORPORATION (US) 2007-09-06 US disclosed