SCHEMBL28544659

SCHEMBL28544659

CCC(c1ccc(O)cc1)c1ccc(O)cc1.[NaH]

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 10/20 0.62
LMNA P02545 2/20 0.62
CYP2C9 P11712 2/20 0.62
TDP1 Q9NUW8 2/20 0.62
CYP1A2 P05177 1/20 0.62
PGR P06401 1/20 0.62
CHRM2 P08172 1/20 0.62
CYP3A4 P08684 1/20 0.62
ADORA3 P0DMS8 1/20 0.62
AR P10275 1/20 0.62
CYP2D6 P10635 1/20 0.62
MAPT P10636 1/20 0.62
CHRM1 P11229 1/20 0.62
ALOX15 P16050 1/20 0.62
DRD1 P21728 1/20 0.62
TBXA2R P21731 1/20 0.62
PTGS1 P23219 1/20 0.62
SLC6A2 P23975 1/20 0.62
CYP2C19 P33261 1/20 0.62
ADRA1A P35348 1/20 0.62

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
SCHEMBL1171043 0.97 ESR1 (0.65) ESR1LMNACYP2C9TDP1CYP1A2
SCHEMBL74326 0.97 ESR1 (0.65) ESR1LMNACYP2C9TDP1CYP1A2
Hydroquinone SCHEMBL28097256 0.97 ESR1 (0.65) ESR1LMNACYP2C9TDP1CYP1A2
Propane SCHEMBL28264453 0.95 ESR1 (0.62) ESR1LMNACYP2C9TDP1CYP1A2
Benzene SCHEMBL28219933 0.95 ESR1 (0.62) ESR1LMNACYP2C9TDP1CYP1A2
Bicarbonate SCHEMBL10591562 0.91 ESR1 (0.58) ESR1LMNACYP2C9TDP1CYP1A2
SCHEMBL361277 0.91 LMNA (0.58) ESR1LMNACYP2C9TDP1CYP1A2
SCHEMBL3155611 0.91 ESR1 (0.58) ESR1LMNACYP2C9TDP1CYP1A2
SCHEMBL10608742 0.91 ESR1 (0.58) ESR1LMNACYP2C9TDP1CYP1A2
SCHEMBL28236288 0.91 ESR1 (0.58) ESR1LMNACYP2C9TDP1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112574148-B Preparation method of 4,4'- (4,4' -isopropylidenediphenoxy) bis (phthalic anhydride) 天津众泰材料科技有限公司 2022-08-16 CN claimed
CN-112574148-A Preparation method of 4,4'- (4,4' -isopropylidenediphenoxy) bis (phthalic anhydride) 天津市众泰化工科技有限公司 2021-03-30 CN claimed
CN-112574148-B Preparation method of 4,4'- (4,4' -isopropylidenediphenoxy) bis (phthalic anhydride) 天津众泰材料科技有限公司 2022-08-16 CN disclosed
CN-112574148-A Preparation method of 4,4'- (4,4' -isopropylidenediphenoxy) bis (phthalic anhydride) 天津市众泰化工科技有限公司 2021-03-30 CN disclosed