SCHEMBL6692069

SCHEMBL6692069

O=C(CBr)Nc1c(Br)cccc1C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.42
PRNP P04156 1/20 0.41
FABP4 P15090 1/20 0.41
POLB P06746 2/20 0.41
MEN1 O00255 3/20 0.40
ALDH1A1 P00352 3/20 0.39
ALOX15 P16050 2/20 0.39
TSHR P16473 1/20 0.39
CYP2C19 P33261 1/20 0.39
HIF1A Q16665 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
F2R P25116 1/20 0.38
KDM4E B2RXH2 1/20 0.38
LMNA P02545 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL10750818 0.86 ALDH1A1 (0.42) KMT2APOLBMEN1ALDH1A1ALOX15
SCHEMBL6692065 0.83 KDM4E (0.48) KMT2APOLBMEN1ALDH1A1KDM4E
SCHEMBL8478828 0.82 TSHR (0.49) KMT2AFABP4POLBMEN1ALDH1A1
SCHEMBL22406054 0.82 POLB (0.59) KMT2APOLBMEN1ALDH1A1ALOX15
SCHEMBL6692448 0.79 TSHR (0.50) KMT2APOLBMEN1ALDH1A1ALOX15
SCHEMBL8691067 0.78 LTB4R (0.52) KMT2AFABP4MEN1ALDH1A1KDM4E
SCHEMBL15620035 0.78 MIF (0.45) KMT2AALDH1A1LMNASMN1; SMN2
SCHEMBL27976592 0.75 PRNP (0.46) KMT2APRNPFABP4POLBMEN1
SCHEMBL17824683 0.75 PRNP (0.46) KMT2APRNPFABP4POLBMEN1
SCHEMBL16655884 0.75 KMT2A (0.58) KMT2APOLBMEN1ALDH1A1TSHR

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