SCHEMBL5863348

SCHEMBL5863348

Cc1nc2ccc(N)cc2c(=O)n1Cc1ccccc1

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.81
ALDH1A1 P00352 2/20 0.81
HPGD P15428 2/20 0.81
SMN1; SMN2 Q16637 1/20 0.81
HSD17B10 Q99714 1/20 0.81
DHFR P00374 2/20 0.61
MEN1 O00255 6/20 0.57
KMT2A Q03164 6/20 0.57
POLB P06746 2/20 0.54
BRD4 O60885 1/20 0.53
HDAC3 O15379 1/20 0.52
HDAC4 P56524 1/20 0.52
HDAC1 Q13547 1/20 0.52
HDAC7 Q8WUI4 1/20 0.52
HDAC2 Q92769 1/20 0.52
HDAC10 Q969S8 1/20 0.52
HDAC11 Q96DB2 1/20 0.52
HDAC8 Q9BY41 1/20 0.52
HDAC6 Q9UBN7 1/20 0.52
HDAC9 Q9UKV0 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
SCHEMBL2314577 0.86 SMN1; SMN2 (0.80) KDM4EALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL31196722 0.85 SMN1; SMN2 (0.70) KDM4EALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL615476 0.82 TNF (0.68) KDM4EALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL14159142 0.81 SMN1; SMN2 (0.55) KDM4EALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL5864193 0.80 MEN1 (0.88) ALDH1A1HPGDSMN1; SMN2DHFRMEN1
SCHEMBL28594238 0.80 KDM4E (0.67) KDM4EALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL617824 0.79 TNF (0.68) KDM4EALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL1882530 0.78 SMN1; SMN2 (0.62) KDM4EALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL24166490 0.77 ALDH1A1 (0.60) KDM4EALDH1A1HPGDSMN1; SMN2HSD17B10
SCHEMBL30656860 0.77 ALDH1A1 (0.60) KDM4EALDH1A1HPGDSMN1; SMN2HSD17B10

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 KDM4E 2536/4885ALDH1A1 1345/4885HPGD 775/4885

“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.