SCHEMBL6047033

SCHEMBL6047033

BrCC(Br)(Oc1ccccc1)Oc1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.39
LTA4H P09960 3/20 0.39
KCNA3 P22001 1/20 0.39
ALDH1A1 P00352 2/20 0.36
TRPA1 O75762 1/20 0.36
CA4 P22748 1/20 0.36
TAAR1 Q96RJ0 1/20 0.34
RECQL P46063 1/20 0.34
TDP1 Q9NUW8 1/20 0.33
ALOX15 P16050 1/20 0.33
CA5A P35218 1/20 0.32
CA5B Q9Y2D0 1/20 0.32
RIPK1 Q13546 1/20 0.31
MAOB P27338 1/20 0.31
HDAC3 O15379 1/20 0.31
HDAC4 P56524 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC7 Q8WUI4 1/20 0.31
HDAC2 Q92769 1/20 0.31
HDAC10 Q969S8 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
SCHEMBL1685761 0.80 TSHR (0.39) TSHRLTA4HKCNA3ALDH1A1TRPA1
SCHEMBL7018083 0.76 CA4 (0.39) TSHRLTA4HKCNA3ALDH1A1TRPA1
SCHEMBL3924731 0.76 TSHR (0.36) TSHRLTA4HKCNA3ALDH1A1TRPA1
SCHEMBL6046969 0.73 TSHR (0.33) TSHRLTA4HKCNA3ALDH1A1TRPA1
SCHEMBL465075 0.73 LTA4H (0.47) TSHRLTA4HKCNA3ALDH1A1CA4
SCHEMBL20718764 0.70 LTA4H (0.39) TSHRLTA4HKCNA3ALDH1A1CA4
SCHEMBL7089314 0.69 LTA4H (0.50) TSHRLTA4HKCNA3ALDH1A1TRPA1
SCHEMBL10592534 0.69 CA4 (0.46) TSHRLTA4HKCNA3ALDH1A1CA4
SCHEMBL10503197 0.69 TSHR (0.43) TSHRLTA4HKCNA3ALDH1A1CA4
SCHEMBL6046974 0.69 LTA4H (0.43) TSHRLTA4HKCNA3ALDH1A1CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060292450-A1 Non-aqueous electrolyte secondary battery MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. 2006-12-28 US disclosed