SCHEMBL4850418

SCHEMBL4850418

N=C(N)Nc1cccc2cnccc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 14/20 0.56
MAPT P10636 11/20 0.56
KDM4E B2RXH2 9/20 0.56
SMN1; SMN2 Q16637 7/20 0.56
KMT2A Q03164 6/20 0.56
LMNA P02545 6/20 0.56
HTT P42858 6/20 0.53
MEN1 O00255 3/20 0.53
BLM P54132 3/20 0.53
HPGD P15428 2/20 0.53
THRB P10828 1/20 0.53
CASP3 P42574 1/20 0.53
SENP8 Q96LD8 1/20 0.53
SENP7 Q9BQF6 1/20 0.53
SENP6 Q9GZR1 1/20 0.53
TRPV1 Q8NER1 3/20 0.52
NSD2 O96028 1/20 0.52
MAPK1 P28482 1/20 0.51
TP53 P04637 1/20 0.51
POLB P06746 1/20 0.51

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
SCHEMBL2315592 0.84 KDM4E (0.67) ALDH1A1MAPTKDM4ESMN1; SMN2KMT2A
SCHEMBL30544195 0.84 KDM4E (0.67) ALDH1A1MAPTKDM4ESMN1; SMN2KMT2A
Hydrochloric Acid SCHEMBL2319974 0.83 KDM4E (0.65) ALDH1A1MAPTKDM4ESMN1; SMN2KMT2A
SCHEMBL30227787 0.81 KDM4E (0.71) ALDH1A1MAPTKDM4ESMN1; SMN2KMT2A
SCHEMBL1741823 0.81 KDM4E (0.71) ALDH1A1MAPTKDM4ESMN1; SMN2KMT2A
SCHEMBL23332049 0.80 KMT2A (0.61) ALDH1A1MAPTKDM4ESMN1; SMN2KMT2A
SCHEMBL5660097 0.80 TRPV1 (0.71) TRPV1
Hydrochloric Acid SCHEMBL9438453 0.79 KDM4E (0.69) ALDH1A1MAPTKDM4ESMN1; SMN2KMT2A
SCHEMBL30114438 0.79 TRPV1 (0.64) ALDH1A1MAPTKDM4ESMN1; SMN2KMT2A
SCHEMBL4023786 0.79 TRPV1 (0.64) ALDH1A1MAPTKDM4ESMN1; SMN2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7439360-B2 Vanilloid receptor ligands and their use in treatments AMGEN INC. (US) 2008-10-21 US disclosed
US-7439360-B2 Vanilloid receptor ligands and their use in treatments AMGEN INC. (US) 2008-10-21 US disclosed
US-7439360-B2 Vanilloid receptor ligands and their use in treatments AMGEN INC. (US) 2008-10-21 US disclosed
EP-1802605-A1 IMIDAZOLE DERIVATIVES AS VANILLOID RECEPTOR LIGANDS Amgen, Inc (US) 2007-07-04 EP disclosed
WO-2006044527-A1 IMIDAZOLE DERIVATIVES AS VANILLOID RECEPTOR LIGANDS AMGEN INC. (US) 2006-04-27 WO disclosed
US-20060084640-A1 Vanilloid receptor ligands and their use in treatments AMGEN INC. 2006-04-20 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-20060084640-A1 Vanilloid receptor ligands and their use in treatments TRPV1, TRPV3, TRPV2 ALDH1A1 2416/4885MAPT 980/4885KDM4E 3248/4885

“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.