SCHEMBL13429796

SCHEMBL13429796

Sc1cc(Br)c(Br)c(Br)c1

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 1/20 0.53
CA2 P00918 2/20 0.36
CA4 P22748 2/20 0.36
CA1 P00915 1/20 0.36
CA6 P23280 1/20 0.36
TDP1 Q9NUW8 1/20 0.35
AKR1B1 P15121 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
SCHEMBL22610099 0.73 TRPV4 (0.35)
SCHEMBL4921701 0.73 TSHR (0.35)
SCHEMBL10835305 0.73 MAPT (0.58) CA2CA1
SCHEMBL13429752 0.72 APEX1 (0.60) APEX1
SCHEMBL48236 0.71 APEX1 (0.44) APEX1CA2CA4CA1CA6
Benzenethiol SCHEMBL27872637 0.70 ALDH1A1 (0.39) APEX1TDP1
SCHEMBL6660944 0.69 APEX1 (0.60) APEX1CA2CA4CA1CA6
SCHEMBL7170676 0.69 APEX1 (1.00) APEX1CA2CA4CA1CA6
Benzenethiol SCHEMBL27914411 0.68 ALDH1A1 (0.38) APEX1TDP1
SCHEMBL1765606 0.67 ALDH1A1 (0.32)

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-20100069603-A1 METHOD FOR PRODUCING STRUCTURE WHEREIN AROMATIC POLYMER IS BONDED TO BASE, STRUCTURE HAVING AROMATIC POLYMER CHAIN BONDED TO CONDUCTIVE BASE, AND ELECTRONIC DEVICE COMPRISING THE STRUCTURE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-03-18 US disclosed
US-20100069603-A1 METHOD FOR PRODUCING STRUCTURE WHEREIN AROMATIC POLYMER IS BONDED TO BASE, STRUCTURE HAVING AROMATIC POLYMER CHAIN BONDED TO CONDUCTIVE BASE, AND ELECTRONIC DEVICE COMPRISING THE STRUCTURE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-03-18 US disclosed