SCHEMBL9614780

SCHEMBL9614780

O=C(OCCO)c1ccc(OCCO)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.61
MAPT P10636 3/20 0.56
NR1I2 O75469 1/20 0.55
ALDH1A1 P00352 4/20 0.51
LMNA P02545 4/20 0.51
SCN1A P35498 1/20 0.51
SCN2A Q99250 1/20 0.51
SCN3A Q9NY46 1/20 0.51
RECQL P46063 1/20 0.50
RAB9A P51151 1/20 0.50
L3MBTL1 Q9Y468 3/20 0.49
TDP1 Q9NUW8 2/20 0.49
TSHR P16473 3/20 0.47
CYP1A2 P05177 2/20 0.47
CYP2C19 P33261 2/20 0.47
ESR1 P03372 2/20 0.47
CYP2D6 P10635 1/20 0.47
MAPK1 P28482 1/20 0.47
NR1H2 P55055 1/20 0.47
RNASEL Q05823 1/20 0.47

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
SCHEMBL18682478 0.90 GAA (0.54) GAAMAPTALDH1A1LMNASCN1A
SCHEMBL18682479 0.90 GAA (0.54) GAAMAPTNR1I2ALDH1A1LMNA
SCHEMBL18682429 0.89 RARB (0.60) NR1I2ALDH1A1LMNARECQLTSHR
SCHEMBL18682428 0.89 ALDH1A1 (0.53) GAAMAPTNR1I2ALDH1A1LMNA
SCHEMBL18682411 0.89 ALDH1A1 (0.53) GAAMAPTNR1I2ALDH1A1LMNA
SCHEMBL15927327 0.89 RARB (0.60) NR1I2ALDH1A1LMNARECQLTSHR
SCHEMBL18682243 0.88 GAA (0.53) GAAMAPTALDH1A1LMNARAB9A
SCHEMBL26378 0.88 TDP1 (0.56) GAAMAPTALDH1A1LMNARAB9A
SCHEMBL6867384 0.87 TDP1 (0.64) GAAMAPTNR1I2ALDH1A1LMNA
SCHEMBL1531975 0.87 ALDH1A1 (0.56) GAAMAPTALDH1A1LMNASCN1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3991034-A POWDER PAINT NIPPON ESTER CO., LTD. (JA) 1976-11-09 US claimed
US-3954901-A HEXAKIS(ALKOXYMETHYL)MELAMINE HARDENER NIPPON ESTER CO., LTD. (JA) 1976-05-04 US claimed
JP-4110322-A None JP disclosed
JP-H04110322-A PREPARATION OF MOLTEN LIQUID CRYSTALLINE POLYESTER TORAY IND INC 1992-04-10 JP disclosed
US-4542232-A Process for preparing hydroxyethyl p-(β hydroxyethoxy)benzoate THE DOW CHEMICAL COMPANY (US) 1985-09-17 US disclosed
US-4153766-A AUTOMATICALLY CONTROLLING MELT VISCOSITY KANEBO LTD. (JP) 1979-05-08 US disclosed
US-3991034-A POWDER PAINT NIPPON ESTER CO., LTD. (JA) 1976-11-09 US disclosed
US-3966406-A Process for jet dyeing fibrous articles containing polyester-type synthetic fibers TEIJIN LIMITED (JA) 1976-06-29 US disclosed
US-3954901-A HEXAKIS(ALKOXYMETHYL)MELAMINE HARDENER NIPPON ESTER CO., LTD. (JA) 1976-05-04 US disclosed