SCHEMBL4901928

SCHEMBL4901928

COc1ccc(-c2ccccn2)nc1Nc1ccccn1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
NPC1 O15118 4/20 0.48
RAB9A P51151 4/20 0.48
GRM5 P41594 2/20 0.48
ASIC3 Q9UHC3 1/20 0.48
MECP2 P51608 1/20 0.47
KCNN1 Q92952 1/20 0.47
KCNN2 Q9H2S1 1/20 0.47
MBD2 Q9UBB5 1/20 0.47
KCNN3 Q9UGI6 1/20 0.47
PTK2 Q05397 1/20 0.46
IGF1R P08069 1/20 0.44
SMN1; SMN2 Q16637 4/20 0.44
MAPT P10636 3/20 0.44
LMNA P02545 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
TRPM8 Q7Z2W7 2/20 0.44
MITF O75030 1/20 0.44
ADORA3 P0DMS8 1/20 0.44

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
SCHEMBL4902559 0.86 ATM (0.45) MEN1KMT2ANPC1RAB9AGRM5
SCHEMBL4901247 0.85 GRM5 (0.48) MEN1KMT2ANPC1RAB9AGRM5
SCHEMBL4902684 0.85 KDR (0.42) MEN1KMT2ANPC1RAB9AGRM5
SCHEMBL4902558 0.84 TRPM8 (0.45) GRM5ASIC3PTK2SMN1; SMN2MAPT
Hydrochloric Acid SCHEMBL4900785 0.84 GRM5 (0.50) MEN1KMT2ANPC1RAB9AGRM5
SCHEMBL4899470 0.82 GRM5 (0.50) MEN1KMT2ANPC1RAB9AGRM5
SCHEMBL4899246 0.82 RAB9A (0.48) MEN1KMT2ANPC1RAB9AGRM5
SCHEMBL4892374 0.81 GRM5 (0.53) MEN1KMT2ANPC1RAB9AGRM5
Hydrochloric Acid SCHEMBL5309347 0.81 RAB9A (0.47) MEN1KMT2ANPC1RAB9AGRM5
SCHEMBL2820941 0.81 TRPM8 (0.68) MEN1KMT2ASMN1; SMN2MAPTLMNA

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-20080108600-A1 Polycyclic Pyridines as Potassium Ion Channel Modulators ICAGEN, INC. (US) 2008-05-08 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-20080108600-A1 Polycyclic Pyridines as Potassium Ion Channel Modulators KCNJ2, KCNH2, KCNQ1 MEN1 2428/4885KMT2A 563/4885NPC1 1509/4885

“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.