SCHEMBL7801433

SCHEMBL7801433

O=C(NCCO)OCc1cccc2c1Cc1ccccc1-2

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.47
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
EPHX1 P07099 3/20 0.40
HTT P42858 2/20 0.39
LMNA P02545 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
DRD2 P14416 2/20 0.38
DRD4 P21917 2/20 0.38
DRD3 P35462 2/20 0.38
HTR7 P34969 1/20 0.37
HTR2B P41595 1/20 0.37
KEAP1 Q14145 2/20 0.37
NFE2L2 Q16236 2/20 0.37
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
PSEN1 P49768 1/20 0.35
PSEN2 P49810 1/20 0.35
APH1B Q8WW43 1/20 0.35
NCSTN Q92542 1/20 0.35

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
SCHEMBL230689 0.93 PNMT (0.45) PNMTNPC1RAB9AEPHX1HTT
SCHEMBL5553226 0.89 PNMT (0.52) PNMTNPC1RAB9AEPHX1HTT
SCHEMBL5553245 0.89 PNMT (0.46) PNMTNPC1RAB9AEPHX1HTT
SCHEMBL29541016 0.89 HTT (0.47) PNMTNPC1RAB9AEPHX1HTT
SCHEMBL6030527 0.89 HTT (0.47) PNMTNPC1RAB9AEPHX1HTT
SCHEMBL30272577 0.89 PNMT (0.52) PNMTNPC1RAB9AEPHX1HTT
SCHEMBL6375587 0.89 PNMT (0.46) PNMTNPC1RAB9AEPHX1HTT
Hydrochloric Acid SCHEMBL25194566 0.88 PNMT (0.51) PNMTNPC1RAB9AEPHX1HTT
SCHEMBL31192378 0.88 PNMT (0.48) PNMTNPC1RAB9AEPHX1HTT
Bromide SCHEMBL15676440 0.88 PNMT (0.51) PNMTNPC1RAB9AEPHX1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118702907-A High polymer-based dispersing agent, preparation method thereof and application thereof in preparation of carbon nano tube dispersion liquid 长春工业大学 2024-09-27 CN claimed
CN-108727426-B Preparation method of diacyl phosphatidyl ethanolamine 安庆润科生物医药科技有限公司 2020-09-29 CN claimed
CN-118702907-A High polymer-based dispersing agent, preparation method thereof and application thereof in preparation of carbon nano tube dispersion liquid 长春工业大学 2024-09-27 CN disclosed
CN-110343117-B Process for the preparation of artemisinin derivatives 中国科学院上海药物研究所 2023-06-09 CN disclosed
CN-108727426-B Preparation method of diacyl phosphatidyl ethanolamine 安庆润科生物医药科技有限公司 2020-09-29 CN disclosed
CN-108727426-B Preparation method of diacyl phosphatidyl ethanolamine 安庆润科生物医药科技有限公司 2020-09-29 CN disclosed
EP-0739898-B1 Phosphonomonoester nucleic acids, methods for their preparation and their use AVENTIS PHARMA GMBH (DE) 2001-09-26 EP disclosed
US-6127346-A FOR THE TREATMENT OF VIRUSES HOECHST AKTIENGESELLSCHAFT (DE) 2000-10-03 US disclosed
US-5874553-A ANTIBODIES; INHIBITOR OF GENE EXPRESSION HOECHST AKTIENGESELLSCHAFT (DE) 1999-02-23 US disclosed
EP-0739898-A2 Phosphonomonoester nucleic acids, methods for their preparation and their use HOECHST AKTIENGESELLSCHAFT (DE) 1996-10-30 EP disclosed