SCHEMBL6691248

SCHEMBL6691248

O=C(CCl)Nc1cccc(C(=O)O)c1NC(=O)CCl

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.58
SMN1; SMN2 Q16637 5/20 0.53
KMT2A Q03164 5/20 0.49
MEN1 O00255 3/20 0.49
BLM P54132 2/20 0.49
LMNA P02545 5/20 0.48
KDM4E B2RXH2 5/20 0.48
HTT P42858 3/20 0.47
HPGD P15428 3/20 0.44
CYP2C9 P11712 1/20 0.44
PTGER4 P35408 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
POLB P06746 1/20 0.44
MAPT P10636 1/20 0.44
CTSK P43235 1/20 0.44
NPC1 O15118 1/20 0.44
MITF O75030 1/20 0.44
RAB9A P51151 1/20 0.44
CLCN2 P51788 1/20 0.43
HSD17B10 Q99714 1/20 0.42

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
SCHEMBL31439507 0.84 ALDH1A1 (0.73) ALDH1A1SMN1; SMN2KMT2AMEN1BLM
SCHEMBL4395595 0.84 ALDH1A1 (0.73) ALDH1A1SMN1; SMN2KMT2AMEN1BLM
SCHEMBL6695143 0.83 KDM4E (0.48) ALDH1A1SMN1; SMN2KMT2AMEN1LMNA
SCHEMBL6691256 0.83 ALDH1A1 (0.51) ALDH1A1SMN1; SMN2KMT2AMEN1LMNA
SCHEMBL6692065 0.83 KDM4E (0.48) ALDH1A1SMN1; SMN2KMT2AMEN1LMNA
SCHEMBL6692060 0.83 KDM4E (0.48) ALDH1A1SMN1; SMN2KMT2AMEN1LMNA
SCHEMBL7235813 0.82 ALDH1A1 (0.59) ALDH1A1SMN1; SMN2KMT2AMEN1BLM
SCHEMBL9474574 0.82 POLB (0.59) ALDH1A1SMN1; SMN2KMT2AMEN1BLM
SCHEMBL6691260 0.79 KDM4E (0.56) ALDH1A1SMN1; SMN2LMNAKDM4EHPGD
SCHEMBL2966492 0.76 SOAT1 (0.59) ALDH1A1SMN1; SMN2KMT2ALMNAKDM4E

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-0950669-B1 Method of catalytic crosslinking of polymers and two-pack composition used therein ROHM & HAAS (US) 2004-09-08 EP disclosed
US-6306991-B1 TWO PART COATING COMPOSITION WITH TWO CONTAINERS, OXIDATIVE POLYMERS WITH CROSSLINKABLE FUNCTIONAL GROUPS ROHM AND HAAS COMPANY 2001-10-23 US disclosed
US-6149977-A CONTACTING THE OXIDATIVE POLYMER WITH A CATALYTIC AMOUNT OF AN OXIDIZING ENZYME, SUCH AS HORSERADISH PEROXIDASE. ROHM AND HAAS COMPANY (US) 2000-11-21 US disclosed
EP-0950669-A2 Method of catalytic crosslinking of polymers and two-pack composition used therein ROHM AND HAAS COMPANY (US) 1999-10-20 EP disclosed