SCHEMBL19657013

SCHEMBL19657013

N=C(N)c1ccc(-c2ccccc2O)o1

nearest known ligand 0.62

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HSD17B1 P14061 1/20 0.47
SLC9A1 P19634 8/20 0.42
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
KMT2A Q03164 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
NQO2 P16083 1/20 0.39

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
SCHEMBL19656844 0.81 SLC9A1 (0.61) SLC9A1MEN1ALDH1A1KMT2A
SCHEMBL3077834 0.78 HPGD (0.50) HSD17B1MEN1ALDH1A1KMT2A
SCHEMBL19657077 0.77 SLC9A1 (0.64) SLC9A1ALDH1A1NPSR1
SCHEMBL23566022 0.76 NQO2 (0.50) ALDH1A1NQO2
SCHEMBL7352974 0.76 NQO2 (0.65) SLC9A1ALDH1A1NQO2
SCHEMBL22931244 0.73 ALDH1A1 (0.67) SLC9A1ALDH1A1
Nitrafudam SCHEMBL121333 0.73 SLC9A1 (0.66) SLC9A1MEN1ALDH1A1KMT2A
SCHEMBL395347 0.72 NQO2 (0.63) SLC9A1ALDH1A1NQO2
SCHEMBL31337366 0.69 LMNA (0.72) MEN1ALDH1A1KMT2ANPSR1
SCHEMBL19629253 0.68 SLC9A1 (0.63) SLC9A1

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-10314820-B2 Imidazole-based heterocyclic compounds PROCOMCURE BIOTECH GMBH (AT) 2019-06-11 US disclosed
US-20170340613-A1 Novel Imidazole-Based Heterocyclic Compounds PROCOMCURE BIOTECH GMBH (AT) 2017-11-30 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 (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-20170340613-A1 Novel Imidazole-Based Heterocyclic Compounds SLC11A2, MIF, NISCH HSD17B1 1593/4885SLC9A1 3586/4885MEN1 1989/4885
US-10314820-B2 Imidazole-based heterocyclic compounds MIF, SLC11A2, TLR5 HSD17B1 1237/4885SLC9A1 3248/4885MEN1 1538/4885

“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.