SCHEMBL24200046

SCHEMBL24200046

O=C(OCc1ccccc1)N1CCCN(Cc2ccccc2)CC1

nearest known ligand 0.64

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.58
KMT2A Q03164 2/20 0.58
MEN1 O00255 1/20 0.58
SMN1; SMN2 Q16637 3/20 0.57
NPC1 O15118 1/20 0.57
RAB9A P51151 1/20 0.57
CYP2C19 P33261 1/20 0.54
PKM P14618 1/20 0.54
ALDH1A1 P00352 4/20 0.54
LMNA P02545 1/20 0.54
FNTA P49354 1/20 0.53
FNTB P49356 1/20 0.53
PGGT1B P53609 1/20 0.53
HRH3 Q9Y5N1 1/20 0.53
GRIN2B Q13224 2/20 0.53
KDM4E B2RXH2 1/20 0.52

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
SCHEMBL25414776 0.93 MEN1 (0.51) NPSR1KMT2AMEN1SMN1; SMN2NPC1
SCHEMBL12018089 0.92 KMT2A (0.56) NPSR1KMT2AMEN1SMN1; SMN2NPC1
SCHEMBL22418871 0.91 SIGMAR1 (0.52) NPSR1KMT2AMEN1SMN1; SMN2NPC1
SCHEMBL16611411 0.90 MEN1 (0.69) NPSR1KMT2AMEN1SMN1; SMN2NPC1
SCHEMBL9819725 0.89 ALDH1A1 (0.64) SMN1; SMN2CYP2C19PKMALDH1A1KDM4E
SCHEMBL25417483 0.89 ALDH1A1 (0.62) KMT2AMEN1SMN1; SMN2NPC1RAB9A
SCHEMBL5109854 0.88 MEN1 (0.71) NPSR1KMT2AMEN1SMN1; SMN2NPC1
SCHEMBL15688093 0.88 TMEM97 (0.60) NPSR1KMT2AMEN1SMN1; SMN2NPC1
SCHEMBL4595454 0.88 KMT2A (0.57) NPSR1KMT2AMEN1SMN1; SMN2NPC1
Hydrochloric Acid SCHEMBL29864758 0.87 MEN1 (0.69) NPSR1KMT2AMEN1SMN1; SMN2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12630487-B2 Method for introducing deuterated lower alkyl into amine moiety of compound containing secondary amine OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2026-05-19 US disclosed
EP-3939954-B1 METHOD FOR INTRODUCING DEUTERATED LOWER ALKYL INTO AMINE MOIETY OF COMPOUND CONTAINING SECONDARY AMINE OTSUKA PHARMA CO LTD (JP) 2025-07-23 EP disclosed
US-20220127206-A1 METHOD FOR INTRODUCING DEUTERATED LOWER ALKYL INTO AMINE MOIETY OF COMPOUND CONTAINING SECONDARY AMINE OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2022-04-28 US disclosed
EP-3939954-A1 METHOD FOR INTRODUCING DEUTERATED LOWER ALKYL INTO AMINE MOIETY OF COMPOUND CONTAINING SECONDARY AMINE Otsuka Pharmaceutical Co., Ltd. (JP) 2022-01-19 EP disclosed
EP-3939954-A1 METHOD FOR INTRODUCING DEUTERATED LOWER ALKYL INTO AMINE MOIETY OF COMPOUND CONTAINING SECONDARY AMINE Otsuka Pharmaceutical Co., Ltd. (JP) 2022-01-19 EP disclosed
CN-113518771-A Method for introducing deuterated lower alkyl into amine part of compound containing secondary amine 大塚制药株式会社 2021-10-19 CN disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20220127206-A1 METHOD FOR INTRODUCING DEUTERATED LOWER ALKYL INTO AMINE MOIETY OF COMPOUND CONTAINING SECONDARY AMINE MGMT, FANCD2, ADAR NPSR1 3935/4885KMT2A 60/4885MEN1 562/4885
US-12630487-B2 Method for introducing deuterated lower alkyl into amine moiety of compound containing secondary amine AZI2, ALKBH2, MGMT NPSR1 3789/4885KMT2A 64/4885MEN1 957/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.