SCHEMBL27969320

SCHEMBL27969320

CC(CCOP(=O)(O)OP(=O)(O)OP(=O)(O)O)Cc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
BTN3A1 O00481 2/20 0.43
TSHR P16473 1/20 0.41
LAP3 P28838 5/20 0.40
ANPEP P15144 2/20 0.39
PIN1 Q13526 3/20 0.39
ACP3 P15309 1/20 0.38
MVD P53602 1/20 0.37
FNTA P49354 1/20 0.36
FNTB P49356 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
SCHEMBL9555519 0.75 PIN1 (0.40) TSHRLAP3ANPEPPIN1ACP3
SCHEMBL3366802 0.75 BTN3A1 (0.52) BTN3A1TSHRANPEPACP3MVD
Biphenyl SCHEMBL6700610 0.74 FNTA (0.48) BTN3A1FNTAFNTB
SCHEMBL3677401 0.73 BTN3A1 (0.49) BTN3A1MVDFNTAFNTB
SCHEMBL4993129 0.73 BTN3A1 (0.49) BTN3A1TSHRMVDFNTAFNTB
SCHEMBL27373081 0.73 BTN3A1 (0.42) BTN3A1TSHRACP3MVD
SCHEMBL8235290 0.72 SIGMAR1 (0.47) LAP3
SCHEMBL21310680 0.72 MVD (0.50) BTN3A1MVDFNTAFNTB
SCHEMBL1110552 0.71 TSHR (0.78) BTN3A1TSHRFNTAFNTB
SCHEMBL155705 0.70 BTN3A1 (0.53) BTN3A1MVDFNTAFNTB

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
CN-103865685-A Degreasing dry cleaning agent NANTONG HAICHEN PROTEIN SCIENCE & TECHNOLOGY CO LTD 2014-06-18 CN disclosed