SCHEMBL17199779

SCHEMBL17199779

C(CCOCCCCCC1CCCO1)CCC1CCCO1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.50
LMNA P02545 1/20 0.41
POLB P06746 1/20 0.41
TSHR P16473 2/20 0.40
HPGD P15428 3/20 0.40
TP53 P04637 1/20 0.40
ALOX12 P18054 1/20 0.40
ALDH1A1 P00352 4/20 0.37
TDP1 Q9NUW8 1/20 0.37
USP2 O75604 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
SPHK2 Q9NRA0 2/20 0.35
SPHK1 Q9NYA1 1/20 0.35
TLR7 Q9NYK1 2/20 0.34
HTT P42858 1/20 0.33

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
SCHEMBL7637763 0.98 EPHX1 (0.47) EPHX1LMNAPOLBTSHRHPGD
SCHEMBL5071286 0.91 EPHX1 (0.43) EPHX1LMNAPOLBTSHRHPGD
SCHEMBL3382033 0.89 EPHX1 (0.61) EPHX1TSHRALDH1A1TDP1SMN1; SMN2
SCHEMBL3379496 0.89 EPHX1 (0.61) EPHX1TSHRALDH1A1TDP1SMN1; SMN2
SCHEMBL251209 0.89 EPHX1 (0.61) EPHX1TSHRALDH1A1TDP1SMN1; SMN2
SCHEMBL2472388 0.89 EPHX1 (0.61) EPHX1TSHRALDH1A1TDP1SMN1; SMN2
SCHEMBL250637 0.89 EPHX1 (0.61) EPHX1TSHRALDH1A1TDP1SMN1; SMN2
SCHEMBL3684347 0.89 EPHX1 (0.60) EPHX1LMNAPOLBTSHRHPGD
SCHEMBL13294283 0.89 EPHX1 (0.60) EPHX1LMNAPOLBTSHRHPGD
SCHEMBL3381884 0.87 EPHX1 (0.58) EPHX1TSHRALDH1A1TDP1SMN1; SMN2

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
CN-111978445-B Low cis-polybutadiene rubber, preparation method and application thereof, and aromatic vinyl resin and preparation method 中国石油化工股份有限公司 2023-05-12 CN claimed
EP-2937918-A1 HINDERED GLYMES FOR ELECTROLYTE COMPOSITIONS CIC Energigune (ES) 2015-10-28 EP claimed
CN-119505127-A Low cis-polybutadiene rubber and preparation method thereof, HIPS resin and preparation method thereof 中国石油化工股份有限公司 2025-02-25 CN disclosed
CN-111978445-B Low cis-polybutadiene rubber, preparation method and application thereof, and aromatic vinyl resin and preparation method 中国石油化工股份有限公司 2023-05-12 CN disclosed
CN-111978446-B Polybutadiene rubber, preparation method and application thereof, and aromatic vinyl resin and preparation method thereof 中国石油化工股份有限公司 2023-05-09 CN disclosed
CN-111978447-B Low cis-polybutadiene rubber, preparation method and application thereof, aromatic vinyl resin and preparation method thereof 中国石油化工股份有限公司 2023-04-11 CN disclosed
EP-2937918-A1 HINDERED GLYMES FOR ELECTROLYTE COMPOSITIONS CIC Energigune (ES) 2015-10-28 EP disclosed