SCHEMBL11744801

SCHEMBL11744801

O=C(COP(=O)(O)O)c1ccccc1.[NaH]

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.49
POLB P06746 1/20 0.49
TDP1 Q9NUW8 3/20 0.48
MAPT P10636 3/20 0.48
MAPK1 P28482 2/20 0.48
KMT2A Q03164 2/20 0.48
HPGD P15428 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
KDM4E B2RXH2 1/20 0.48
MEN1 O00255 1/20 0.48
CYP3A4 P08684 1/20 0.48
ALOX15 P16050 1/20 0.48
CES1 P23141 1/20 0.48
NPC1 O15118 5/20 0.46
RAB9A P51151 4/20 0.46
GSK3B P49841 2/20 0.45
ALDH1A1 P00352 2/20 0.45
PIN1 Q13526 2/20 0.45
TRPA1 O75762 1/20 0.45
HIF1A Q16665 1/20 0.45

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
SCHEMBL2773685 0.98 LMNA (0.50) LMNAPOLBTDP1MAPTMAPK1
SCHEMBL10570188 0.86 TSHR (0.52) LMNAPOLBTDP1MAPTMAPK1
SCHEMBL2773681 0.84 MAPT (0.52) LMNAPOLBTDP1MAPTMAPK1
SCHEMBL9316272 0.83 LMNA (0.51) LMNAPOLBTDP1MAPTMAPK1
SCHEMBL9316270 0.81 LMNA (0.53) LMNAPOLBTDP1MAPTMAPK1
SCHEMBL15227043 0.81 NPC1 (0.49) POLBTDP1MAPTKDM4ENPC1
SCHEMBL11744807 0.81 LMNA (0.49) LMNAPOLBTDP1MAPTMAPK1
SCHEMBL11037946 0.81 LMNA (0.53) LMNAPOLBTDP1MAPTMAPK1
SCHEMBL27755237 0.78 LMNA (0.54) LMNAPOLBTDP1MAPTMAPK1
SCHEMBL10878397 0.77 POLB (0.57) LMNAPOLBTDP1MAPTMAPK1

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-4017615-A ESPECIALLY USEFUL FOR ANTIINFLAMMATORY TOPICAL CORTICOIDS SYNTEX CORPORATION (PM) 1977-04-12 US disclosed
US-3962275-A ANTIGONADOTROPIC AGENTS HOFFMANN-LA ROCHE INC. (US) 1976-06-08 US disclosed