SCHEMBL6698097

SCHEMBL6698097

CCCN(C(C)=O)c1ccc(C)cc1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
ALDH1A1 P00352 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MLYCD O95822 1/20 0.41
MAPT P10636 1/20 0.41
TSPO P30536 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
SCHEMBL13791114 0.87 RAB9A (0.53) TP53MEN1KMT2AALDH1A1RAB9A
SCHEMBL10963549 0.86 ALDH1A1 (0.47) TP53ALDH1A1SMN1; SMN2MLYCDMAPT
SCHEMBL13791513 0.86 NPC1 (0.55) TP53ALDH1A1RAB9AMLYCD
SCHEMBL10282142 0.84 ALDH1A1 (0.48) MEN1KMT2AALDH1A1RAB9ASMN1; SMN2
SCHEMBL14174972 0.84 MEN1 (0.43) TP53MEN1KMT2AALDH1A1RAB9A
SCHEMBL15215895 0.83 POLB (0.49) TP53MEN1KMT2AALDH1A1MLYCD
SCHEMBL8016233 0.83 MLYCD (0.40) TP53MEN1KMT2AALDH1A1RAB9A
SCHEMBL7830726 0.83 MEN1 (0.45) TP53MEN1KMT2AALDH1A1RAB9A
SCHEMBL6037568 0.83 TP53 (0.43) TP53ALDH1A1SMN1; SMN2MLYCDMAPT
SCHEMBL2069635 0.82 TP53 (0.59) TP53MEN1KMT2AALDH1A1RAB9A

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