SCHEMBL4904703

SCHEMBL4904703

O=C(OCCCCc1ccccc1C(=O)O)c1ccc(O)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 3/20 0.58
ESR2 Q92731 1/20 0.58
TDP1 Q9NUW8 3/20 0.57
LMNA P02545 2/20 0.54
PRKCG P05129 2/20 0.54
PRKCB P05771 2/20 0.54
PRKCA P17252 2/20 0.54
PRKCE Q02156 2/20 0.54
PRKCD Q05655 2/20 0.54
TSHR P16473 2/20 0.54
CYP2D6 P10635 2/20 0.54
PRKCH P24723 1/20 0.54
CYP1A2 P05177 1/20 0.54
MAPK1 P28482 1/20 0.54
CYP2C19 P33261 1/20 0.54
NR1H2 P55055 1/20 0.54
RNASEL Q05823 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
ALDH1A1 P00352 1/20 0.49
CHRM1 P11229 1/20 0.49

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
SCHEMBL4907924 0.92 ESR1 (0.66) ESR1ESR2TDP1LMNAPRKCG
SCHEMBL2480484 0.85 TSHR (0.61) ESR1TDP1LMNATSHRCYP2D6
SCHEMBL4904716 0.85 TDP1 (0.59) ESR1ESR2TDP1LMNAPRKCG
Benzoic Acid Hexyl Ester SCHEMBL29700572 0.84 ALDH1A1 (0.62) TDP1LMNATSHRMAPK1ALDH1A1
SCHEMBL9442368 0.84 ALDH1A1 (0.62) TDP1LMNATSHRMAPK1ALDH1A1
SCHEMBL30125107 0.84 ALDH1A1 (0.62) TDP1LMNATSHRMAPK1ALDH1A1
SCHEMBL5153066 0.83 TDP1 (0.81) ESR1ESR2TDP1LMNATSHR
SCHEMBL30356392 0.82 TDP1 (0.59) ESR1TDP1LMNATSHRCYP2D6
SCHEMBL4907156 0.82 TDP1 (0.59) ESR1ESR2TDP1LMNAPRKCG
SCHEMBL5155759 0.82 TDP1 (0.79) ESR1ESR2TDP1LMNATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080194403-A1 Laser Recording Thermally Sensitive Recording Medium NIPPON PAPER INDUSTRIES CO., LTD. (JP) 2008-08-14 US disclosed
EP-1707399-B1 LASER RECORDING TYPE HEAT-SENSITIVE RECORDING MEDIUM JUJO PAPER CO LTD (JP) 2007-11-28 EP disclosed
US-20070099798-A1 Laser recording thermally sensitive recording medium NAGAI TOMOAKI 2007-05-03 US disclosed
EP-1398169-B1 LASER RECORDING TYPE HEAT SENSITIVE RECORDING ELEMENT JUJO PAPER CO LTD (JP) 2006-11-15 EP disclosed
EP-1707399-A1 LASER RECORDING TYPE HEAT-SENSITIVE RECORDING MEDIUM Nippon Paper Industries Co., Ltd. (JP) 2006-10-04 EP disclosed
US-20040171485-A1 Laser recording type heat sensitive recording element NIPPON PAPER INDUSTRIES CO., LTD. (JP) 2004-09-02 US disclosed
EP-1398169-A1 LASER RECORDING TYPE HEAT SENSITIVE RECORDING ELEMENT Nippon Paper Industries Co., Ltd. (JP) 2004-03-17 EP disclosed