SCHEMBL8616166

SCHEMBL8616166

CCOC(=O)c1ccccc1CP(=O)(OCC)OCC

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.59
ALDH1A1 P00352 4/20 0.51
HSD17B10 Q99714 4/20 0.51
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
LMNA P02545 3/20 0.45
CDC25B P30305 1/20 0.44
NPSR1 Q6W5P4 2/20 0.44
HTT P42858 2/20 0.44
TP53 P04637 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
KDM4E B2RXH2 4/20 0.43
MAPK10 P53779 1/20 0.43
MAPT P10636 1/20 0.43
MAPK1 P28482 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL11004588 0.88 TSHR (0.59) TSHRALDH1A1HSD17B10MEN1KMT2A
SCHEMBL914622 0.88 ALDH1A1 (0.51) TSHRALDH1A1HSD17B10KMT2ALMNA
SCHEMBL8671766 0.86 MAPT (0.42) TSHRALDH1A1KMT2ALMNANPSR1
SCHEMBL31733655 0.84 MAPT (0.51) TSHRALDH1A1KMT2ALMNANPSR1
SCHEMBL915187 0.84 FOLH1 (0.45) TSHRALDH1A1HSD17B10NPSR1HTT
SCHEMBL7219619 0.84 TSHR (0.62) TSHRALDH1A1HSD17B10MEN1KMT2A
SCHEMBL31733476 0.84 TSHR (0.41) TSHRALDH1A1HSD17B10MEN1KMT2A
SCHEMBL7765311 0.83 TSHR (0.56) TSHRALDH1A1HSD17B10MEN1KMT2A
SCHEMBL9449012 0.81 HTT (0.41) TSHRALDH1A1HSD17B10LMNAHTT
SCHEMBL578128 0.80 TSHR (0.77) TSHRALDH1A1HSD17B10MEN1KMT2A

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1080117-C Treatment of tumors with compounds having RXR retinoid receptor agonist activity ALLERGAN INC (US) 2002-03-06 CN disclosed
US-5719303-A USEFUL FOR MEDICALLY TREATING HYPERLIPEMIA EISAI CO., LTD. (JP) 1998-02-17 US disclosed
US-5547983-A Aromatic and polycyclic compounds and their use in human or veterinary medicine and in cosmetics CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (CIRD GALDERMA) (FR) 1996-08-20 US disclosed
CN-1122105-A Treatment of tumors with compounds having RXR retinoid receptor agonist activity ALLERGAN INC (US) 1996-05-08 CN disclosed
EP-0688325-A1 PHOSPHONIC ACID DERIVATIVES Eisai Co., Ltd. (JP) 1995-12-27 EP disclosed
WO-1994020508-A1 PHOSPHONIC ACID DERIVATIVES EISAI CO., LTD. (JP) 1994-09-15 WO disclosed