SCHEMBL6470177

SCHEMBL6470177

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

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.41
NPSR1 Q6W5P4 1/20 0.41
MCOLN3 Q8TDD5 1/20 0.41
TAS1R3 Q7RTX0 4/20 0.39
TAS1R1 Q7RTX1 4/20 0.39
TAS1R2 Q8TE23 4/20 0.39
KMT2A Q03164 4/20 0.38
MEN1 O00255 2/20 0.38
LMNA P02545 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
KDM4E B2RXH2 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
ALDH1A1 P00352 2/20 0.33
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.32

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
SCHEMBL6467319 0.82 KMT2A (0.41) HPGDNPSR1MCOLN3TAS1R3TAS1R1
SCHEMBL6467134 0.80 L3MBTL1 (0.38) HPGDTAS1R3TAS1R1TAS1R2KDM4E
SCHEMBL3195966 0.79 TAS1R3 (0.43) HPGDNPSR1MCOLN3TAS1R3TAS1R1
SCHEMBL1035777 0.78 SMN1; SMN2 (0.38) HPGDNPSR1MCOLN3KMT2AMEN1
SCHEMBL8398622 0.77 TAS1R3 (0.42) HPGDNPSR1MCOLN3TAS1R3TAS1R1
SCHEMBL28106244 0.77 TAS1R3 (0.42) HPGDNPSR1MCOLN3TAS1R3TAS1R1
SCHEMBL69538 0.77 TAS1R3 (0.42) HPGDNPSR1MCOLN3TAS1R3TAS1R1
SCHEMBL15822585 0.77 TAS1R3 (0.42) HPGDNPSR1MCOLN3TAS1R3TAS1R1
SCHEMBL5995309 0.77 HPGD (0.36) HPGDNPSR1MCOLN3TAS1R3TAS1R1
SCHEMBL275128 0.76 KMT2A (0.38) HPGDNPSR1MCOLN3TAS1R3TAS1R1

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-20050096406-A1 Reactive diluents and alkyd resin coating compositions PRETOT ROGER (CH) 2005-05-05 US disclosed
US-5534559-A UNSATURATED POLYESTERS CIBA-GEIGY CORPORATION (US) 1996-07-09 US disclosed