SCHEMBL4430092

SCHEMBL4430092

O=C(CCCCBr)OC1CCCCO1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 2/20 0.41
LMNA P02545 1/20 0.41
POLB P06746 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
MGLL Q99685 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
TP53 P04637 1/20 0.33
HPGD P15428 1/20 0.33
ALOX12 P18054 1/20 0.33
ALDH1A1 P00352 1/20 0.33
USP2 O75604 1/20 0.31

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
SCHEMBL10385001 0.98 NAAA (0.44) NAAALMNAPOLBMEN1KMT2A
SCHEMBL6132130 0.98 NAAA (0.44) NAAALMNAPOLBMEN1KMT2A
SCHEMBL9042040 0.98 NAAA (0.44) NAAALMNAPOLBMEN1KMT2A
SCHEMBL9043156 0.98 NAAA (0.44) NAAALMNAPOLBMEN1KMT2A
SCHEMBL9032916 0.97 LMNA (0.42) NAAALMNAPOLBMEN1KMT2A
SCHEMBL21867399 0.95 LMNA (0.45) NAAALMNAPOLBMEN1KMT2A
SCHEMBL26645767 0.88 LMNA (0.50) NAAALMNAPOLBMEN1KMT2A
SCHEMBL9044854 0.86 NAAA (0.44) NAAALMNAPOLBMEN1KMT2A
SCHEMBL9044455 0.86 NAAA (0.44) NAAALMNAPOLBMEN1KMT2A
SCHEMBL9043889 0.86 NAAA (0.44) NAAALMNAPOLBMEN1KMT2A

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
US-7491752-B2 Photoactive materials ROLIC AG (CH) 2009-02-17 US disclosed
US-20040265742-A1 Photoactive materials ROLIC AG (CH) 2004-12-30 US disclosed
EP-1409563-A1 PHOTOACTIVE MATERIALS Rolic AG (CH) 2004-04-21 EP disclosed
WO-2003008472-A1 PHOTOACTIVE MATERIALS ROLIC AG (CH) 2003-01-30 WO disclosed