SCHEMBL5864048

SCHEMBL5864048

O=C1c2ccnc(Cl)c2CCN1Cc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHPS P49366 3/20 0.58
SMN1; SMN2 Q16637 6/20 0.53
LMNA P02545 4/20 0.53
L3MBTL1 Q9Y468 2/20 0.53
NCOA3 Q9Y6Q9 1/20 0.53
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
IDH1 O75874 1/20 0.49
ALDH1A1 P00352 5/20 0.47
HTT P42858 3/20 0.47
GRM5 P41594 1/20 0.46
POLB P06746 1/20 0.45
PKM P14618 2/20 0.44
DDB1 Q16531 1/20 0.44
CRBN Q96SW2 1/20 0.44
MAPK1 P28482 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
PDE4A P27815 1/20 0.43
PDE4B Q07343 1/20 0.43
PDE4C Q08493 1/20 0.43

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
SCHEMBL21273618 0.86 IDH1 (0.60) DHPSSMN1; SMN2LMNAL3MBTL1NCOA3
SCHEMBL31749760 0.84 IDH1 (0.52) DHPSSMN1; SMN2LMNAL3MBTL1NCOA3
SCHEMBL2108681 0.78 ROCK2 (0.42) DHPSIDH1GRM5MAPK1
SCHEMBL21273566 0.77 IDH1 (0.48) DHPSSMN1; SMN2IDH1ALDH1A1
SCHEMBL29593479 0.77 IDH1 (0.48) DHPSSMN1; SMN2IDH1ALDH1A1
SCHEMBL5812457 0.76 DHPS (0.58) DHPSSMN1; SMN2LMNAL3MBTL1NCOA3
SCHEMBL31569013 0.75 DHPS (0.57) DHPSSMN1; SMN2LMNAL3MBTL1NCOA3
SCHEMBL3000762 0.75 DHPS (0.60) DHPSSMN1; SMN2LMNAL3MBTL1NCOA3
SCHEMBL4991491 0.75 DHPS (0.60) DHPSSMN1; SMN2LMNAL3MBTL1NCOA3
SCHEMBL5863275 0.74 IDH1 (0.46) DHPSSMN1; SMN2LMNAL3MBTL1NCOA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7030120-B2 Nitrogen-containing heterocyclic compounds and benzamide compounds and drugs containing the same MEIJI SEIKA KAISHA, LTD. (JP) 2006-04-18 US disclosed
US-20040224959-A1 Nitrogen-containing heterocyclic compounds and benzamide compounds and drugs containing the same OHKURA NAOTO (JP) 2004-11-11 US disclosed
US-6777414-B1 INHIBITORS OF TRIGLYCERIDE BIOSYNTHESIS AND SECRETION OF APOLIPOPROTEIN B-CONTAINING LIPOPROTEINS; ARTERIOSCLEROTIC DISEASES; HYPERLIPIDEMIA MEIJI SEIKA KAISHA, LTD. (JP) 2004-08-17 US disclosed
EP-1180514-A1 NITROGEN-CONTAINING HETEROCYCLIC COMPOUNDS AND BENAMIDE COMPOUNDS AND DRUGS CONTAINING THE SAME MEIJI SEIKA KAISHA LTD. (JP) 2002-02-20 EP 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-20040224959-A1 Nitrogen-containing heterocyclic compounds and benzamide compounds and drugs containing the same APOB, NCEH1, LIPC DHPS 1834/4885SMN1; SMN2 3590/4885LMNA 508/4885

“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.