SCHEMBL6131076

SCHEMBL6131076

CC(OP(=O)(OCCc1ccccc1)OP(=O)(O)O)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ACP3 P15309 2/20 0.41
CYP2D6 P10635 1/20 0.40
FFAR1 O14842 1/20 0.39
TSHR P16473 2/20 0.37
BTN3A1 O00481 1/20 0.37
ALDH1A1 P00352 1/20 0.37
ANPEP P15144 2/20 0.36
ERAP1 Q9NZ08 2/20 0.36
ERAP2 Q6P179 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
LPAR1 Q92633 2/20 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
SCHEMBL6131075 0.85 ACP3 (0.44) ACP3CYP2D6FFAR1TSHRALDH1A1
SCHEMBL18776475 0.75 ALDH1A1 (0.46) TSHRALDH1A1ANPEPERAP1MEN1
SCHEMBL3366802 0.74 BTN3A1 (0.52) ACP3TSHRBTN3A1ANPEPERAP1
SCHEMBL516899 0.73 TSHR (0.53) ACP3CYP2D6TSHRANPEPERAP1
SCHEMBL3366798 0.73 CA1 (0.46) FFAR1TSHRALDH1A1
SCHEMBL516900 0.73 HCAR2 (0.49) ACP3ALDH1A1ANPEP
SCHEMBL516898 0.73 ALDH1A1 (0.47) ACP3ALDH1A1MEN1KMT2A
SCHEMBL2817045 0.73 CA1 (0.48) FFAR1TSHRALDH1A1
SCHEMBL17567288 0.72 TSHR (0.46) ACP3CYP2D6TSHRALDH1A1ANPEP
SCHEMBL27254360 0.72 CA1 (0.37) MEN1KMT2A

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
US-20050282041-A1 Magnetic recording medium FUJI PHOTO FILM CO., LTD. 2005-12-22 US disclosed