SCHEMBL9323716

SCHEMBL9323716

OCCN(CCBr)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 3/20 0.39
GAA P10253 2/20 0.39
MAPT P10636 3/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
EGFR P00533 1/20 0.36
ERBB2 P04626 1/20 0.36
HTT P42858 3/20 0.36
PKM P14618 1/20 0.36
MCL1 Q07820 1/20 0.36
TSHR P16473 1/20 0.35
PABPC1 P11940 1/20 0.35
NPC1 O15118 1/20 0.34
MITF O75030 1/20 0.34
NSD2 O96028 1/20 0.34
THRB P10828 1/20 0.34
RECQL P46063 1/20 0.34
RAB9A P51151 1/20 0.34

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
SCHEMBL11056830 0.89 TSHR (0.41) ALDH1A1MAPTMEN1KMT2AEGFR
SCHEMBL78451 0.89 KDM4E (0.46) KDM4EALDH1A1GAAMAPTMEN1
Bromide SCHEMBL11628834 0.87 KDM4E (0.44) KDM4EALDH1A1GAAMAPTMEN1
Hydrochloric Acid SCHEMBL28957289 0.87 KDM4E (0.48) KDM4EALDH1A1GAAMAPTMEN1
Ammonia Solution, Strong SCHEMBL28490308 0.87 KDM4E (0.44) KDM4EALDH1A1GAAMAPTMEN1
Boric Acid SCHEMBL30555202 0.83 KDM4E (0.42) KDM4EALDH1A1GAAMAPTMEN1
Perchlorate SCHEMBL30567351 0.81 KDM4E (0.41) KDM4EALDH1A1GAAMAPTMEN1
SCHEMBL28940337 0.80 ALDH1A1 (0.45) KDM4EALDH1A1GAAMAPTMEN1
SCHEMBL13338131 0.79 EGFR (0.54) KDM4EALDH1A1GAAMAPTMEN1
SCHEMBL7186666 0.79 KDM4E (0.40) KDM4EALDH1A1GAAMAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5308735-A Aromatic-aldehyde resins, improved solubility NIPPON PAINT CO., LTD. (JP) 1994-05-03 US disclosed
EP-0540016-A1 Photosensitive resin and resin composition for lithographic printing Nippon Paint Co., Ltd. (JP) 1993-05-05 EP disclosed