SCHEMBL10792102

SCHEMBL10792102

C=CC(CCl)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.39
CYP2C19 P33261 1/20 0.38
HTR2A P28223 2/20 0.36
TAAR1 Q96RJ0 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
ALDH1A1 P00352 2/20 0.34
KDM4E B2RXH2 1/20 0.34
CYP3A4 P08684 1/20 0.34
MAPT P10636 1/20 0.34
ALOX15 P16050 1/20 0.34
DPP4 P27487 2/20 0.33
HRH1 P35367 2/20 0.33
MTOR P42345 1/20 0.33
RAB9A P51151 1/20 0.33
GRM7 Q14831 1/20 0.33
F2 P00734 1/20 0.33
LMNA P02545 1/20 0.32

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
SCHEMBL6016113 0.83 CYP2C19 (0.36) TSHRCYP2C19HTR2ATAAR1SMN1; SMN2
SCHEMBL6016109 0.79 CYP2C19 (0.39) TSHRCYP2C19HTR2ATAAR1SMN1; SMN2
SCHEMBL9921450 0.77 LMNA (0.46) CYP2C19HTR2ATAAR1ALDH1A1HRH1
SCHEMBL19233902 0.77 TAAR1 (0.52) TSHRCYP2C19HTR2ATAAR1CYP3A4
SCHEMBL11518060 0.77 LMNA (0.46) CYP2C19HTR2ATAAR1ALDH1A1HRH1
SCHEMBL11773608 0.77 CYP2C19 (0.42) TSHRCYP2C19HTR2ATAAR1SMN1; SMN2
SCHEMBL14654862 0.77 CYP2C19 (0.42) CYP2C19HTR2ATAAR1SMN1; SMN2ALDH1A1
SCHEMBL4553372 0.77 TAAR1 (0.52) TSHRCYP2C19HTR2ATAAR1CYP3A4
SCHEMBL4667833 0.77 CYP2C19 (0.42) CYP2C19HTR2ATAAR1SMN1; SMN2ALDH1A1
SCHEMBL15393365 0.77 CYP2C19 (0.38) TSHRCYP2C19HTR2ATAAR1SMN1; 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
CN-100339771-C Method for preparing film coating toner TOPPAN FORMS CO LTD (JP) 2007-09-26 CN disclosed
CN-1688940-A film coating toner TOPPAN FORMS CO LTD (JP) 2005-10-26 CN disclosed
US-4663402-A Non-catalytic process for the preparation of difunctionalized polyarylene polyethers THE B. F. GOODRICH COMPANY (US) 1987-05-05 US disclosed