SCHEMBL8637116

SCHEMBL8637116

CN(C)CCOC(=O)c1ccccc1O

nearest known ligand 0.67

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 3/20 0.67
▸ TSHR P16473 4/20 0.53
▸ LMNA P02545 2/20 0.53
▸ ALDH1A1 P00352 3/20 0.51
▸ PHLPP2 Q6ZVD8 1/20 0.51
▸ SCN1A P35498 1/20 0.51
▸ SCN2A Q99250 1/20 0.51
▸ SCN3A Q9NY46 1/20 0.51
▸ L3MBTL1 Q9Y468 3/20 0.50
▸ HTT P42858 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ TP53 P04637 1/20 0.47
▸ CYP3A4 P08684 1/20 0.47
▸ MAPK1 P28482 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
SCHEMBL8642191 0.90 TDP1 (0.73) TDP1TSHRLMNAALDH1A1SCN1A
SCHEMBL28245601 0.90 ALDH1A1 (0.63) TDP1TSHRLMNAALDH1A1PHLPP2
SCHEMBL8641123 0.89 TDP1 (0.71) TDP1TSHRLMNAALDH1A1L3MBTL1
SCHEMBL9636446 0.87 TDP1 (0.50) TDP1TSHRALDH1A1PHLPP2SCN1A
Detanosal SCHEMBL2110875 0.84 SCN1A (0.68) TDP1TSHRLMNAALDH1A1SCN1A
SCHEMBL6063013 0.84 TDP1 (0.85) TDP1TSHRLMNAALDH1A1L3MBTL1
SCHEMBL30416074 0.84 TDP1 (0.85) TDP1TSHRLMNAALDH1A1L3MBTL1
Trimethylammonium SCHEMBL29142303 0.83 TDP1 (0.67) TDP1TSHRLMNAALDH1A1L3MBTL1
SCHEMBL11677653 0.83 ALDH1A1 (0.56) TDP1TSHRLMNAALDH1A1PHLPP2
SCHEMBL8644511 0.83 TDP1 (0.61) TDP1TSHRLMNAALDH1A1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118290278-A 2-Hydroxybenzoic acid-2- (dimethylamino) ethyl ester compound and preparation method and application thereof 四川施成收生态科技有限公司 2024-07-05 — — CN claimed
CN-118290278-A 2-Hydroxybenzoic acid-2- (dimethylamino) ethyl ester compound and preparation method and application thereof 四川施成收生态科技有限公司 2024-07-05 — — CN disclosed
CN-118290278-A 2-Hydroxybenzoic acid-2- (dimethylamino) ethyl ester compound and preparation method and application thereof 四川施成收生态科技有限公司 2024-07-05 — — CN disclosed
CN-118290278-A 2-Hydroxybenzoic acid-2- (dimethylamino) ethyl ester compound and preparation method and application thereof 四川施成收生态科技有限公司 2024-07-05 — — CN disclosed
US-5753407-A Polyamic acid composition KABUSHIKI KAISHA TOSHIBA (JP) 1998-05-19 — — US disclosed
US-5585217-A Polyamic acid composition KABUSHIKI KAISHA TOSHIBA (JP) 1996-12-17 — — US disclosed
US-4298603-A LOCAL ANESTHETICS INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 1981-11-03 — — US disclosed
EP-0031632-A1 O-Aminoalkylsalicylates, process for their preparation, and their pharmaceutical compositions INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 1981-07-08 — — EP disclosed
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