SCHEMBL6652345

SCHEMBL6652345

CCCCCCCCCCOC(=O)c1ccc2cc(O)ccc2c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 7/20 0.63
TSHR P16473 2/20 0.63
LMNA P02545 1/20 0.63
CYP1A2 P05177 1/20 0.63
CYP2D6 P10635 1/20 0.63
MAPK1 P28482 1/20 0.63
CYP2C19 P33261 1/20 0.63
NR1H2 P55055 1/20 0.63
RNASEL Q05823 1/20 0.63
SMN1; SMN2 Q16637 1/20 0.63
ALDH1A1 P00352 2/20 0.58
NPC1 O15118 1/20 0.58
MAPT P10636 1/20 0.58
RAB9A P51151 1/20 0.58
AKR1C4 P17516 1/20 0.58
AKR1C3 P42330 1/20 0.58
AKR1C2 P52895 1/20 0.58
AKR1C1 Q04828 1/20 0.58
STS P08842 5/20 0.54
CHRM1 P11229 1/20 0.54

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
SCHEMBL4945610 1.00 ESR1 (0.63) ESR1TSHRLMNACYP1A2CYP2D6
SCHEMBL6650964 1.00 ESR1 (0.63) ESR1TSHRLMNACYP1A2CYP2D6
SCHEMBL6652236 1.00 ESR1 (0.63) ESR1TSHRLMNACYP1A2CYP2D6
SCHEMBL6648699 0.99 ESR1 (0.65) ESR1TSHRLMNACYP1A2CYP2D6
SCHEMBL6654130 0.94 ESR1 (0.71) ESR1TSHRLMNACYP1A2CYP2D6
SCHEMBL9458337 0.93 ALDH1A1 (0.67) ESR1TSHRLMNACYP1A2CYP2D6
SCHEMBL9458677 0.93 ALDH1A1 (0.67) ESR1TSHRLMNACYP1A2CYP2D6
SCHEMBL4853372 0.93 ALDH1A1 (0.67) ESR1TSHRLMNACYP1A2CYP2D6
SCHEMBL9458309 0.93 ALDH1A1 (0.67) ESR1TSHRLMNACYP1A2CYP2D6
SCHEMBL16632600 0.93 ALDH1A1 (0.67) ESR1TSHRLMNACYP1A2CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1120399-B1 Naphthalene compound, and liquid crystal composition and liquid crystal element using the same MITSUI CHEMICALS INC (JP) 2004-06-09 EP disclosed
EP-1120400-B1 Naphtahlene compound, and liquid crystal composition and liquid crystal element using the same MITSUI CHEMICALS INC (JP) 2003-09-24 EP disclosed
EP-0757032-B1 Naphthalene compound, and liquid crystal composition and liquid crystal element using the same MITSUI CHEMICALS INC (JP) 2001-12-12 EP disclosed
EP-1120400-A1 Naphtahlene compound, and liquid crystal composition and liquid crystal element using the same Mitsui Chemicals, Inc. (JP) 2001-08-01 EP disclosed
EP-1120399-A1 Naphthalene compound, and liquid crystal composition and liquid crystal element using the same Mitsui Chemicals, Inc. (JP) 2001-08-01 EP disclosed
US-5861108-A IMPROVES HIGH SPEED RESPONSE PROPERTY AND TEMPERATURE DEPENDENCY OF THE RESPONSE TIME MITSUI CHEMICALS, INC. (JP) 1999-01-19 US disclosed
EP-0757032-A2 Naphthalene compound, and liquid crystal composition and liquid crystal element using the same MITSUI TOATSU CHEMICALS, INC. (JP) 1997-02-05 EP disclosed
EP-0458320-B1 Mesomorphic compound, liquid crystal composition, liquid crystal device, display apparatus and display method CANON KK (JP) 1995-01-04 EP disclosed
EP-0364923-B1 MESOMORPHIC COMPOUND, LIQUID CRYSTAL COMPOSITION CONTAINING SAME AND LIQUID CRYSTAL DEVICE USING SAME CANON KABUSHIKI KAISHA (JP) 1993-07-28 EP disclosed
US-5188762-A Ferroelectric liquid crystal with high response speed and small temperature dependence CANON KABUSHIKI KAISHA (JP) 1993-02-23 US disclosed
US-5116530-A Ferroelectrical optical apparatus containing thiophene groups CANON KABUSHIKI KAISHA (JP) 1992-05-26 US disclosed
EP-0458320-A1 Mesomorphic compound, liquid crystal composition, liquid crystal device, display apparatus and display method CANON KABUSHIKI KAISHA (JP) 1991-11-27 EP disclosed