SCHEMBL5596206

SCHEMBL5596206

CCCP(c1ccccc1O)c1ccccc1O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.38
ALDH1A1 P00352 4/20 0.38
ALOX15 P16050 3/20 0.38
KDM4E B2RXH2 3/20 0.38
TDP1 Q9NUW8 3/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
CA2 P00918 2/20 0.38
MAPT P10636 2/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
CA12 O43570 1/20 0.38
GMNN O75496 1/20 0.38
EGFR P00533 1/20 0.38
LMNA P02545 1/20 0.38
FYN P06241 1/20 0.38
POLB P06746 1/20 0.38
CA3 P07451 1/20 0.38
CYP3A4 P08684 1/20 0.38
MMP9 P14780 1/20 0.38
HPGD P15428 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
SCHEMBL5596901 0.88 TSHR (0.39) TSHRALDH1A1ALOX15KDM4ETDP1
SCHEMBL6142635 0.82 CA2 (0.41) TSHRALDH1A1ALOX15KDM4ETDP1
SCHEMBL5595894 0.82 ALDH1A1 (0.41) TSHRALDH1A1ALOX15KDM4ETDP1
SCHEMBL29193770 0.76 TSHR (0.39) TSHRALDH1A1KDM4ETDP1CA2
SCHEMBL3307518 0.74 AKR1B1 (0.39) TSHRALDH1A1ALOX15KDM4ETDP1
SCHEMBL10767212 0.74 TRPA1 (0.39) TSHRALDH1A1ALOX15KDM4ETDP1
SCHEMBL5595971 0.74 ALDH1A1 (0.48) ALDH1A1ALOX15KDM4ESMN1; SMN2MAPT
SCHEMBL10760435 0.74 ALDH1A1 (0.40) TSHRALDH1A1MAPTHTTATM
SCHEMBL5596924 0.74 ALOX15 (0.45) ALDH1A1ALOX15TDP1SMN1; SMN2MAPT
Acetic Acid SCHEMBL7158721 0.74 KDM4E (0.36) TSHRALDH1A1KDM4ETDP1SMN1; SMN2

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-7279537-B2 Transition metal complexes and polymerization catalysts SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-10-09 US disclosed
US-20060229195-A1 Transition metal complexes and polymerization catalysts SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-10-12 US disclosed
EP-1557423-A1 TRANSITION METAL COMPLEXES AND POLYMERIZATION CATALYSTS Sumitomo Chemical Company, Limited (JP) 2005-07-27 EP disclosed