SCHEMBL4459436

SCHEMBL4459436

Cc1cc2c(c(Cl)c1O)C1(CC2(C)C)CC(C)(C)c2cc(C)c(O)c(Cl)c21

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HNF4A P41235 1/20 0.35
ACHE P22303 1/20 0.33
CYP3A4 P08684 2/20 0.32
CHRM1 P11229 1/20 0.32
ALOX15 P16050 1/20 0.32
MAOA P21397 1/20 0.32
TBXA2R P21731 1/20 0.32
ADRA1A P35348 1/20 0.32
HTR2B P41595 1/20 0.32
FTO Q9C0B1 1/20 0.32
CYP1A2 P05177 1/20 0.32
RARA P10276 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
SIRT1 Q96EB6 1/20 0.31
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30

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
SCHEMBL4464517 0.84 FTO (0.39) ACHECYP3A4CHRM1ALOX15TBXA2R
SCHEMBL24604252 0.82 CYP3A4 (0.30) CYP3A4CHRM1ALOX15MAOATBXA2R
SCHEMBL4469300 0.82 HNF4A (0.36) HNF4AACHECYP1A2CA1CA2
SCHEMBL9327968 0.79 HNF4A (0.35) HNF4AACHERARACA1CA2
SCHEMBL23406091 0.79 HNF4A (0.35) HNF4AACHECA1CA2
SCHEMBL16203376 0.78 HNF4A (0.34) HNF4AACHE
SCHEMBL24053483 0.76 HNF4A (0.35) HNF4AACHECYP3A4ALOX15CYP1A2
SCHEMBL21565061 0.73 HNF4A (0.33) HNF4A
SCHEMBL8015643 0.73 CYP3A4 (0.38) CYP3A4CHRM1ALOX15MAOATBXA2R
SCHEMBL4462287 0.71 TP53 (0.43) CYP3A4FTOCYP1A2

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-7582355-B2 Optical unit using plastic lenses FUJIFILM CORPORATION (JP) 2009-09-01 US disclosed
US-20060046065-A1 Optical unit using plastic lenses FUJI PHOTO FILM CO., LTD. 2006-03-02 US disclosed
US-6028161-A EXCELLENT TRANSPARENCY, HEAT RESISTANCE AND MECHANICAL PROPERTIES AND A LOW BIREFRINGENCE, MELT FLUIDITY AND MOLDABILITY; AN OPTICAL DISK, LENS AND AN OPTICAL FIBER MITSUI CHEMICALS, INC. (JP) 2000-02-22 US disclosed
EP-0926180-A2 A polycarbonate copolymer and applications thereof Mitsui Chemicals, Inc. (JP) 1999-06-30 EP disclosed