SCHEMBL14430745

SCHEMBL14430745

O=C(NCCCN1CCCCC1)c1[nH]nc2c1CCCC2

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.53
▸ MEN1 O00255 3/20 0.53
▸ ALDH1A1 P00352 2/20 0.53
▸ MAPT P10636 2/20 0.53
▸ GAA P10253 1/20 0.51
▸ GFER P55789 1/20 0.51
▸ SMN1; SMN2 Q16637 1/20 0.51
▸ PARP1 P09874 4/20 0.49
▸ ALOX15 P16050 1/20 0.48
▸ L3MBTL1 Q9Y468 2/20 0.47
▸ LMNA P02545 1/20 0.44
▸ RECQL P46063 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ SMYD2 Q9NRG4 2/20 0.41

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
SCHEMBL23657866 0.71 RAB9A (0.54) ALDH1A1MAPTSMN1; SMN2ALOX15LMNA
SCHEMBL1252549 0.71 PARP1 (0.61) ALDH1A1PARP1
SCHEMBL17927741 0.70 HCAR2 (0.39) KMT2AMEN1ALDH1A1MAPTGAA
SCHEMBL7399854 0.69 HTR1A (0.73) —
SCHEMBL31672497 0.68 L3MBTL1 (0.56) KMT2AMEN1ALDH1A1MAPTGAA
SCHEMBL14430755 0.68 ACHE (0.45) KMT2AMAPTL3MBTL1RECQLTSHR
Hydrochloric Acid SCHEMBL1251976 0.68 PARP1 (0.60) ALDH1A1GAASMN1; SMN2PARP1
SCHEMBL2219175 0.68 KMT2A (1.00) KMT2AMEN1ALDH1A1MAPTGAA
SCHEMBL3896010 0.67 EPHX1 (0.54) KMT2AMEN1ALDH1A1MAPTGAA
SCHEMBL5488104 0.67 KDM4E (0.57) ALDH1A1GAASMN1; SMN2LMNAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070191358-A1 Novel piperidine derivative for the treatment of depression ASTRAZENECA AB (SE) 2007-08-16 — — US disclosed
US-20070191358-A1 Novel piperidine derivative for the treatment of depression ASTRAZENECA AB (SE) 2007-08-16 — — US 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 (1 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-20070191358-A1 Novel piperidine derivative for the treatment of depression GRIN2C, TPH2, HTR5A KMT2A 234/4885MEN1 4813/4885ALDH1A1 172/4885

“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.

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