SCHEMBL6471080

SCHEMBL6471080

CCCCCCN(C)c1ccc(C(N)=O)nn1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NNMT P40261 1/20 0.41
▸ HCAR3 P49019 1/20 0.38
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ APAF1 O14727 1/20 0.36
▸ RGS12 O14924 1/20 0.36
▸ HSP90AA1 P07900 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ AOC3 Q16853 1/20 0.36
▸ GPR84 Q9NQS5 2/20 0.35
▸ NR1I2 O75469 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ CHRM2 P08172 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ ADRA2A P08913 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ OPRK1 P41145 1/20 0.35
▸ HTR2B P41595 1/20 0.35
▸ SLC6A3 Q01959 1/20 0.35
▸ HDAC6 Q9UBN7 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
SCHEMBL11636680 0.82 NNMT (0.47) NNMTHCAR3KMT2AAOC3ADRA2A
SCHEMBL5133216 0.78 NNMT (0.41) NNMTHCAR3MEN1KMT2AAOC3
SCHEMBL11637312 0.77 HCAR3 (0.46) NNMTHCAR3AOC3MAPT
SCHEMBL6471082 0.77 DNM1 (0.36) HCAR3GPR84MAPTPTPN11
SCHEMBL5133491 0.77 HCAR3 (0.43) HCAR3MEN1KMT2AAOC3GPR84
SCHEMBL11637320 0.74 NNMT (0.53) NNMTKMT2ALMNANPC1RAB9A
SCHEMBL27677649 0.72 PIM2 (0.40) HCAR3MEN1KMT2ALMNACYP3A4
SCHEMBL5042470 0.71 HCAR3 (0.46) HCAR3MEN1KMT2AAOC3LMNA
SCHEMBL1733557 0.70 KDM4E (0.65) MEN1KMT2AMAPK1LMNA
SCHEMBL6468479 0.70 PIM2 (0.39) HCAR3MEN1KMT2AAOC3TRPV1

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-20050107381-A1 6-membered heteroaryl compounds for the treatment of neurodegenerative disorders PFIZER, INC. 2005-05-19 — — 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-20050107381-A1 6-membered heteroaryl compounds for the treatment of neurodegenerative disorders APP, BACE1, SNCA NNMT 559/4885HCAR3 748/4885MEN1 978/4885

“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.

Send feedback