SCHEMBL29220627

SCHEMBL29220627

CCCCCCCCCCCCCC(=O)Nc1ccc(NC(=O)C2CCCCC2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 10/20 0.60
▸ L3MBTL1 Q9Y468 1/20 0.58
▸ PTPN1 P18031 1/20 0.57
▸ ALDH1A1 P00352 1/20 0.57
▸ HTT P42858 1/20 0.57
▸ RAB9A P51151 1/20 0.57
▸ ENPP3 O14638 2/20 0.54
▸ ENPP1 P22413 2/20 0.54
▸ HPGD P15428 1/20 0.54
▸ DGAT2 Q96PD7 1/20 0.53
▸ PSMB11 A5LHX3 1/20 0.53
▸ PSMA7 O14818 1/20 0.53
▸ PSMB1 P20618 1/20 0.53
▸ PSMA1 P25786 1/20 0.53
▸ PSMA2 P25787 1/20 0.53
▸ PSMA3 P25788 1/20 0.53
▸ PSMA4 P25789 1/20 0.53
▸ PSMB8 P28062 1/20 0.53
▸ PSMB9 P28065 1/20 0.53
▸ PSMA5 P28066 1/20 0.53

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
SCHEMBL29220633 1.00 ENPP2 (0.60) ENPP2L3MBTL1PTPN1ALDH1A1HTT
SCHEMBL29220677 1.00 ENPP2 (0.60) ENPP2L3MBTL1PTPN1ALDH1A1HTT
SCHEMBL20278585 0.85 PTPN1 (0.56) ENPP2PTPN1ALDH1A1HTTRAB9A
SCHEMBL29220635 0.84 NAAA (0.58) ENPP2PTPN1RAB9AENPP3ENPP1
SCHEMBL675018 0.82 ENPP2 (0.71) ENPP2L3MBTL1ALDH1A1RAB9AHPGD
SCHEMBL9510547 0.82 ENPP2 (0.71) ENPP2L3MBTL1ALDH1A1RAB9AHPGD
SCHEMBL9858666 0.82 ENPP2 (0.71) ENPP2L3MBTL1ALDH1A1RAB9AHPGD
SCHEMBL498337 0.82 NAAA (0.63) ENPP2PTPN1ALDH1A1HTTRAB9A
SCHEMBL13973509 0.81 POLB (0.67) ENPP2PTPN1RAB9AENPP3ENPP1
SCHEMBL22679393 0.79 POLB (0.69) ENPP2PTPN1RAB9AENPP3ENPP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119039684-A Polymer-based PTC composite material based on pi-pi interaction, preparation method and application 四川大学 2024-11-29 — — CN claimed
CN-117820776-A Polymer-based composite material with low dielectric constant and low dielectric loss, and preparation method and application thereof 四川大学 2024-04-05 — — CN claimed
CN-117820776-A Polymer-based composite material with low dielectric constant and low dielectric loss, and preparation method and application thereof 四川大学 2024-04-05 — — CN disclosed
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