SCHEMBL28149403

SCHEMBL28149403

CCc1ccc(OP(=O)(O)Oc2ccc(C)cc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.64
SMN1; SMN2 Q16637 1/20 0.64
CYP3A4 P08684 1/20 0.52
TSHR P16473 1/20 0.52
MAPT P10636 3/20 0.44
MEN1 O00255 1/20 0.44
LMNA P02545 1/20 0.44
KMT2A Q03164 1/20 0.44
CES2 O00748 1/20 0.43
CES1 P23141 1/20 0.43
BLM P54132 1/20 0.42
SRC P12931 1/20 0.41
POLB P06746 1/20 0.40
P2RY14 Q15391 1/20 0.40
PTK2B Q14289 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPK1 P28482 1/20 0.40

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
SCHEMBL2150400 0.93 SMN1; SMN2 (0.72) CYP2C19SMN1; SMN2MAPTLMNAKMT2A
SCHEMBL28043975 0.88 CYP2C19 (0.58) CYP2C19SMN1; SMN2CYP3A4TSHRMAPT
SCHEMBL157866 0.87 TSHR (0.67) CYP3A4TSHRMAPTMEN1LMNA
SCHEMBL28672551 0.86 CYP2C19 (0.53) CYP2C19SMN1; SMN2CYP3A4TSHRMAPT
SCHEMBL23501799 0.86 CYP2C19 (0.64) CYP2C19SMN1; SMN2CES2CES1SRC
SCHEMBL28672554 0.85 CYP2C19 (0.51) CYP2C19SMN1; SMN2CYP3A4TSHRMAPT
SCHEMBL1983846 0.85 TSHR (0.64) CYP3A4TSHRMAPTMEN1LMNA
SCHEMBL8884790 0.85 TSHR (0.64) CYP3A4TSHRMAPTMEN1LMNA
Fluoride SCHEMBL31047203 0.85 TSHR (0.64) CYP3A4TSHRMAPTMEN1LMNA
Ethylenediamine SCHEMBL8467918 0.81 TSHR (0.55) CYP2C19SMN1; SMN2CYP3A4TSHRMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106795719-A Antiflaming floor material and its manufacture method 乐金华奥斯株式会社 2017-05-31 CN disclosed