SCHEMBL26531998

SCHEMBL26531998

C=CC(=C)OCCCc1ccc(N(c2ccc(CCCOC(=O)C=C)cc2)c2ccc(-c3ccccc3)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
THRB P10828 3/20 0.44
AKR1B10 O60218 2/20 0.40
AKR1B1 P15121 2/20 0.40
LMNA P02545 1/20 0.40
TSHR P16473 2/20 0.38
HPGD P15428 1/20 0.38
HDAC2 Q92769 2/20 0.37
NPC1 O15118 1/20 0.37
RECQL P46063 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ALDH1A1 P00352 1/20 0.37
CYP3A4 P08684 1/20 0.37
MGLL Q99685 4/20 0.37
FFAR1 O14842 1/20 0.37
ALOX5 P09917 1/20 0.36
HDAC1 Q13547 1/20 0.36
HCAR2 Q8TDS4 1/20 0.36

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
SCHEMBL2602486 0.94 THRB (0.49) THRBAKR1B10AKR1B1LMNATSHR
SCHEMBL25830899 0.93 THRB (0.48) THRBAKR1B10AKR1B1LMNATSHR
SCHEMBL20613617 0.92 THRB (0.49) THRBAKR1B10AKR1B1LMNATSHR
SCHEMBL12454726 0.89 THRB (0.47) THRBAKR1B10AKR1B1LMNATSHR
SCHEMBL12534108 0.88 THRB (0.52) THRBAKR1B10AKR1B1LMNATSHR
SCHEMBL18333495 0.88 THRB (0.52) THRBAKR1B10AKR1B1LMNATSHR
SCHEMBL12214253 0.87 THRB (0.51) THRBAKR1B10AKR1B1LMNATSHR
SCHEMBL12402272 0.87 THRB (0.51) THRBTSHRHPGDALDH1A1CYP3A4
SCHEMBL16489102 0.87 THRB (0.56) THRBAKR1B10AKR1B1LMNATSHR
SCHEMBL23893938 0.86 THRB (0.44) THRBAKR1B10AKR1B1LMNATSHR

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
US-20230324818-A1 ELECTROPHOTOGRAPHIC PHOTORECEPTOR, PRODUCING METHOD OF ELECTROPHOTOGRAPHIC PHOTORECEPTOR, AND IMAGE FORMING APPARATUS Konica Minolta, Inc. (JP) 2023-10-12 US disclosed
US-20230324818-A1 ELECTROPHOTOGRAPHIC PHOTORECEPTOR, PRODUCING METHOD OF ELECTROPHOTOGRAPHIC PHOTORECEPTOR, AND IMAGE FORMING APPARATUS Konica Minolta, Inc. (JP) 2023-10-12 US disclosed