SCHEMBL26784274

SCHEMBL26784274

Cc1cc(C)c(C(=O)P(=O)(CCC(=O)OCCOCCCCCCOCCOC(=O)CCP(=O)(C(=O)c2c(C)cc(C)cc2C)C(=O)c2c(C)cc(C)cc2C)C(=O)c2c(C)cc(C)cc2C)c(C)c1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 3/20 0.33
THRA P10827 1/20 0.33
DGKA P23743 1/20 0.33
ITGB1 P05556 1/20 0.32
ITGA4 P13612 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HDAC3 O15379 1/20 0.31
HDAC4 P56524 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC7 Q8WUI4 1/20 0.31
HDAC2 Q92769 1/20 0.31
HDAC10 Q969S8 1/20 0.31
HDAC11 Q96DB2 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
HDAC9 Q9UKV0 1/20 0.31
HDAC5 Q9UQL6 1/20 0.31
POLB P06746 1/20 0.31
TAS1R3 Q7RTX0 2/20 0.30
TAS1R1 Q7RTX1 2/20 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
SCHEMBL17827614 0.91 CRHR1 (0.33) SMN1; SMN2ALDH1A1
SCHEMBL17827612 0.91 SMN1; SMN2 (0.34) DGKAITGB1ITGA4SMN1; SMN2POLB
SCHEMBL15635791 0.90 ALDH1A1 (0.34) THRBSMN1; SMN2POLBALDH1A1
SCHEMBL1038238 0.83 ITGB1 (0.40) THRBTHRADGKAITGB1ITGA4
SCHEMBL17192835 0.81 DNM1 (0.40) THRBTHRASMN1; SMN2ALDH1A1
SCHEMBL15637257 0.80 TDP1 (0.32) ALDH1A1
SCHEMBL2886656 0.78 CRHR1 (0.34) SMN1; SMN2POLBTAS1R3TAS1R1TAS1R2
SCHEMBL1038469 0.78 CRHR1 (0.34) SMN1; SMN2POLBTAS1R3TAS1R1TAS1R2
SCHEMBL17827611 0.78 TDP1 (0.31)
SCHEMBL2712918 0.77 CRHR1 (0.37) SMN1; SMN2POLBTAS1R3TAS1R1TAS1R2

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
WO-2023214010-A1 PHOTOINITIATOR PACKAGE COMPRISING SPECIALISED BISACYLPHOSPHINE OXIDE PHOTOINITIATORS AND OPTICAL BRIGHTENER SENSITIZERS IGM GROUP B. V. (NL) 2023-11-09 WO disclosed
EP-4273200-A1 PHOTOINITIATOR PACKAGE COMPRISING SPECIALISED BISACYLPHOSPHINE OXIDE PHOTOINITIATORS AND OPTICAL BRIGHTENER SENSITIZERS IGM Group B.V. (NL) 2023-11-08 EP disclosed