SCHEMBL28048645

SCHEMBL28048645

CCCCCCOC(F)COCCO

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.55
MEN1 O00255 1/20 0.55
THRB P10828 1/20 0.55
KMT2A Q03164 1/20 0.55
MAPT P10636 1/20 0.55
USP2 O75604 1/20 0.49
TSHR P16473 1/20 0.45
LPAR1 Q92633 5/20 0.44
LPAR3 Q9UBY5 5/20 0.44
LPAR2 Q9HBW0 2/20 0.44
SPHK1 Q9NYA1 1/20 0.40
DNM1 Q05193 1/20 0.39
TLR2 O60603 1/20 0.38
LPAR5 Q9H1C0 2/20 0.38
LPAR6 P43657 1/20 0.38
LPAR4 Q99677 1/20 0.38

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
SCHEMBL6247348 0.81 HTT (0.64) HTTMEN1THRBKMT2AMAPT
SCHEMBL17213401 0.81 LPAR1 (0.51) HTTMEN1THRBKMT2AMAPT
SCHEMBL2730257 0.80 HTT (0.57) HTTMEN1THRBKMT2AMAPT
SCHEMBL28161776 0.80 HTT (0.57) HTTMEN1THRBKMT2AMAPT
SCHEMBL5267993 0.80 HTT (0.57) HTTMEN1THRBKMT2AMAPT
SCHEMBL6134150 0.79 USP2 (0.47) HTTMEN1THRBKMT2AMAPT
SCHEMBL18738907 0.79 LPAR1 (0.55) HTTMEN1THRBKMT2AMAPT
SCHEMBL11436367 0.78 HTT (0.53) HTTMEN1THRBKMT2AMAPT
SCHEMBL10484508 0.78 HTT (0.53) HTTMEN1THRBKMT2AMAPT
SCHEMBL3590634 0.77 MEN1 (0.63) HTTMEN1THRBKMT2AMAPT

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
CN-105246944-B Polycarbonate copolymer, method for producing polycarbonate copolymer, coating liquid using polycarbonate copolymer, molded body, and electrophotographic photoreceptor 出光兴产株式会社 2018-06-22 CN disclosed
CN-105246944-A Polycarbonate copolymer, coating liquid using same, molded body, and electrophotographic photoreceptor IDEMITSU KOSAN CO 2016-01-13 CN disclosed