SCHEMBL6858682

SCHEMBL6858682

OCNc1c2ccccc2cc2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
POLB P06746 3/20 0.44
KDM4E B2RXH2 3/20 0.44
GLA P06280 2/20 0.44
RAD52 P43351 2/20 0.44
LMNA P02545 2/20 0.44
MITF O75030 1/20 0.44
TTR P02766 1/20 0.44
GAA P10253 1/20 0.44
RAB9A P51151 1/20 0.44
HTR2A P28223 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
HSD17B10 Q99714 2/20 0.42
CYP1A2 P05177 2/20 0.42
HPGD P15428 2/20 0.42
CYP2C19 P33261 1/20 0.42
TRPM4 Q8TD43 1/20 0.40
HIF1A Q16665 1/20 0.39

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
SCHEMBL27911511 0.78 HTR2A (0.43) ALDH1A1POLBKDM4EGLARAD52
SCHEMBL8851401 0.78 BTK (0.44) ALDH1A1KDM4EGLAGAARAB9A
SCHEMBL10362358 0.77 POLB (0.49) ALDH1A1POLBKDM4EGLARAD52
SCHEMBL8851369 0.75 IDO1 (0.44) ALDH1A1POLBKDM4EGLARAD52
SCHEMBL27911506 0.75 POLB (0.42) ALDH1A1POLBKDM4EGLARAD52
SCHEMBL8851619 0.75 KMT2A (0.67) ALDH1A1POLBKDM4ERAD52LMNA
SCHEMBL2837802 0.74 ALDH1A1 (0.48) ALDH1A1KDM4EGLAHTR2AL3MBTL1
Hydrochloric Acid SCHEMBL31741337 0.74 ALDH1A1 (0.58) ALDH1A1POLBKDM4EGLARAD52
SCHEMBL12627432 0.74 HTR2A (0.39) ALDH1A1POLBKDM4EGLARAD52
SCHEMBL14559183 0.74 HTR2A (0.39) ALDH1A1POLBKDM4EGLARAD52

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6803168-B1 ACRYLIC OR METHACRYLIC POLYMER WITH AN ISOCYANATE GROUP BONDED THROUGH AN ALKYLENE GROUP TO A SIDE CHAIN THEREOF OR WITH AN AMINO OR HYDROXYL GROUP-CONTAINING ORGANIC CHROMOPHORE WHICH ABSORBS RADIATION IN THE RANGE OF 100 TO 450 NM WAVELENGTH CLARIANT FINANCE (BVI) LIMITED (VG) 2004-10-12 US disclosed
EP-0917002-B1 COMPOSITION FOR ANTIREFLECTION OR LIGHT ABSORPTION FILM AND COMPOUNDS FOR USE IN THE SAME CLARIANT FINANCE BVI LTD (VG) 2004-03-17 EP disclosed
EP-0917002-A1 COMPOSITION FOR ANTIREFLECTION OR LIGHT ABSORPTION FILM AND COMPOUNDS FOR USE IN THE SAME CLARIANT INTERNATIONAL LTD. (CH) 1999-05-19 EP disclosed