SCHEMBL17997271

SCHEMBL17997271

Fc1cc(Br)ccc1C1CCCC1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 4/20 0.55
KDM1B Q8NB78 1/20 0.55
PTGDR Q13258 1/20 0.42
PTGDR2 Q9Y5Y4 1/20 0.42
OPRL1 P41146 5/20 0.41
ALDH1A1 P00352 1/20 0.37
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
MAPT P10636 1/20 0.37
KMT2A Q03164 1/20 0.37
DGAT1 O75907 1/20 0.36
CCR1 P32246 1/20 0.35
CCR2 P41597 1/20 0.35
CEL P19835 1/20 0.34
NOS3 P29474 1/20 0.34
NOS1 P29475 1/20 0.34
NOS2 P35228 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
SCHEMBL5100126 0.98 KDM1A (0.53) KDM1AKDM1BPTGDRPTGDR2OPRL1
SCHEMBL8243578 0.92 KDM1A (0.58) KDM1AKDM1BOPRL1ALDH1A1DGAT1
SCHEMBL29739167 0.92 KDM1A (0.58) KDM1AKDM1BOPRL1ALDH1A1DGAT1
SCHEMBL31222976 0.83 KDM1A (0.50) KDM1AKDM1B
SCHEMBL28506116 0.80 KDM1A (0.47) KDM1AKDM1BOPRL1NOS3NOS1
SCHEMBL436724 0.79 OPRL1 (0.58) PTGDR2OPRL1
SCHEMBL10019957 0.78 OPRL1 (0.47) KDM1AKDM1BOPRL1
SCHEMBL435254 0.78 OPRL1 (0.59) PTGDRPTGDR2OPRL1
SCHEMBL126724 0.78 PTGDR (0.46) KDM1AKDM1BPTGDRPTGDR2ALDH1A1
SCHEMBL22778088 0.77 KDM1A (0.56) KDM1AKDM1BMEN1KMT2ADGAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9540565-B2 Liquid crystal compounds containing dibenzopyran derivatives of naphthenic base and application thereof SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIALS CO., LTD (CN) 2017-01-10 US disclosed
US-9540565-B2 Liquid crystal compounds containing dibenzopyran derivatives of naphthenic base and application thereof SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIALS CO., LTD (CN) 2017-01-10 US disclosed
US-20160230092-A1 LIQUID CRYSTAL COMPOUNDS CONTAINING DIBENZOPYRAN DERIVATIVES OF NAPHTHENIC BASE AND APPLICATION THEREOF SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIALS CO., LTD (CN) 2016-08-11 US disclosed
US-20160230092-A1 LIQUID CRYSTAL COMPOUNDS CONTAINING DIBENZOPYRAN DERIVATIVES OF NAPHTHENIC BASE AND APPLICATION THEREOF SHIJIAZHUANG CHENGZHI YONGHUA DISPLAY MATERIALS CO., LTD (CN) 2016-08-11 US disclosed