SCHEMBL7124670

SCHEMBL7124670

Cc1ccc(-n2c[c]nc2)cc1Cl

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.40
MEN1 O00255 3/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
POLB P06746 2/20 0.40
ATM Q13315 1/20 0.40
PKM P14618 2/20 0.39
SMN1; SMN2 Q16637 4/20 0.37
MAPT P10636 3/20 0.37
ALDH1A1 P00352 2/20 0.37
HPGD P15428 2/20 0.37
GFER P55789 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.36
LMNA P02545 1/20 0.36
CYP3A4 P08684 1/20 0.36
GAA P10253 1/20 0.35
RECQL P46063 1/20 0.35
USP2 O75604 1/20 0.35
HSD17B10 Q99714 1/20 0.35

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
SCHEMBL2089216 0.84 NOTUM (0.43) SMN1; SMN2MAPTALDH1A1L3MBTL1LMNA
SCHEMBL10053481 0.77 PKM (0.48) KMT2AMEN1NPC1RAB9APOLB
SCHEMBL2096016 0.77 CYP11B2 (0.36)
SCHEMBL1895994 0.72 IDO1 (0.53) KMT2APKMSMN1; SMN2MAPTALDH1A1
SCHEMBL22641616 0.71 NOTUM (0.58) KMT2AMEN1MAPTLMNACYP3A4
SCHEMBL9042829 0.71 PKM (0.45) KMT2AMEN1NPC1RAB9APOLB
SCHEMBL1898382 0.67 ALDH1A1 (0.45) KMT2ANPC1RAB9APKMSMN1; SMN2
SCHEMBL4435850 0.66 NOTUM (0.46) KMT2AMEN1NPC1RAB9APOLB
SCHEMBL2098320 0.66 HCAR1 (0.33) ALDH1A1
SCHEMBL22641636 0.66 KMT2A (0.53) KMT2AMEN1NPC1RAB9APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030191311-A1 A 5-(imidazol-1-yl-methyl)-pyridine derivatives for treating an NMDA-receptor-mediated disease, neurodegeneration disorder caused by stroke or brain trauma, Alzheimer's disease, Parkinson's disease, Huntington's disease EVOTEC INTERNATIONAL GMBH (DE) 2003-10-09 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-20030191311-A1 A 5-(imidazol-1-yl-methyl)-pyridine derivatives for treating an NMDA-receptor-mediated disease, neurodegeneration disorder caused by stroke or brain trauma, Alzheimer's disease, Parkinson's disease, Huntington's disease GRIN1, GRIN2B, GRIN3B KMT2A 377/4885MEN1 4125/4885NPC1 933/4885

“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.