SCHEMBL15967965

SCHEMBL15967965

CCCCCCCCCCc1nc2c(Br)ccc(Br)c2nc1CCCCCCCCCC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 2/20 0.46
DHFR P00374 1/20 0.40
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
ESR1 P03372 2/20 0.37
ADRA2A P08913 2/20 0.37
ADORA3 P0DMS8 2/20 0.37
TACR2 P21452 2/20 0.37
SLC6A2 P23975 2/20 0.37
SLC6A4 P31645 2/20 0.37
SLC6A3 Q01959 2/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
SHBG P04278 1/20 0.37
TP53 P04637 1/20 0.37
CYP3A4 P08684 1/20 0.37
HSPD1 P10809 1/20 0.37
ADRB3 P13945 1/20 0.37
HTR2C P28335 1/20 0.37

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
SCHEMBL14762926 1.00 KCNH2 (0.46) KCNH2DHFRTDP1L3MBTL1ESR1
SCHEMBL621757 1.00 KCNH2 (0.46) KCNH2DHFRTDP1L3MBTL1ESR1
SCHEMBL14789232 0.92 KCNH2 (0.40) KCNH2DHFRTDP1L3MBTL1ESR1
SCHEMBL12184577 0.90 KCNH2 (0.41) KCNH2DHFRTDP1L3MBTL1ALDH1A1
SCHEMBL15979469 0.86 KCNH2 (0.36) KCNH2DHFRTDP1L3MBTL1
SCHEMBL16204102 0.85 KCNH2 (0.39) KCNH2DHFRPTGS2GPR84
SCHEMBL14789240 0.84 KCNH2 (0.37) KCNH2DHFRKDM4EALDH1A1GPR84
SCHEMBL27952344 0.83 KCNH2 (0.39) KCNH2DHFRTDP1L3MBTL1ESR1
SCHEMBL27964266 0.83 KCNH2 (0.46) KCNH2DHFRTDP1L3MBTL1ALDH1A1
SCHEMBL27832413 0.83 KCNH2 (0.46) KCNH2DHFRTDP1L3MBTL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9166073-B2 Method for producing conjugated polymer, conjugated polymer, photoelectric conversion element, solar cell, and solar cell module MITSUBISHI CHEMICAL CORPORATION (JP) 2015-10-20 US disclosed
EP-2774931-A1 PROCESS FOR PRODUCING FUSED-RING AROMATIC COMPOUND, AND CONJUGATED POLYMER Mitsubishi Chemical Corporation (JP) 2014-09-10 EP disclosed
EP-2774940-A1 METHOD FOR PRODUCING CONJUGATED POLYMER, CONJUGATED POLYMER, PHOTOELECTRIC CONVERSION ELEMENT, SOLAR CELL, AND SOLAR CELL MODULE Mitsubishi Chemical Corporation (JP) 2014-09-10 EP disclosed
US-20140243492-A1 METHOD FOR PRODUCING CONDENSED POLYCYCLIC AROMATIC COMPOUND, AND CONJUGATED POLYMER MITSUBISHI CHEMICAL CORPORATION (JP) 2014-08-28 US disclosed
US-20140243488-A1 METHOD FOR PRODUCING CONJUGATED POLYMER, CONJUGATED POLYMER, PHOTOELECTRIC CONVERSION ELEMENT, SOLAR CELL, AND SOLAR CELL MODULE MITSUBISHI CHEMICAL CORPORATION (JP) 2014-08-28 US disclosed
CN-103917575-A Method for producing conjugated polymer, photoelectric conversion element, solar cell, and solar cell module MITSUBISHI CHEM CORP 2014-07-09 CN disclosed