SCHEMBL5219178

SCHEMBL5219178

O=CN(c1ccc(Br)cc1)c1cnc(Cc2c(Cl)cccc2Cl)[nH]1

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ TAAR1 Q96RJ0 2/20 0.37
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ PTGES O14684 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31

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
SCHEMBL14422201 0.67 KMT2A (0.45) MEN1KMT2AALDH1A1
SCHEMBL5217667 0.66 CCNA2 (0.32) TAAR1
SCHEMBL14422199 0.64 TAAR1 (0.46) TAAR1MEN1KMT2A
SCHEMBL3091401 0.63 CYP2A6 (0.42) MEN1KMT2AALDH1A1
Hydrochloric Acid SCHEMBL5215090 0.63 TAAR1 (0.45) TAAR1MEN1KMT2A
SCHEMBL5217205 0.60 MMP2 (0.56) TAAR1MEN1KMT2AALDH1A1
SCHEMBL953627 0.56 TAAR1 (1.00) TAAR1MEN1KMT2A
SCHEMBL3333154 0.55 TAAR1 (0.55) TAAR1KMT2A
SCHEMBL10548341 0.55 GPBAR1 (0.42) ALDH1A1
SCHEMBL4203963 0.55 TAAR1 (0.45) TAAR1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7265138-B2 Vanilloid receptor ligands and their use in treatments AMGEN INC. (US) 2007-09-04 — — US disclosed
EP-1818333-A1 Vanilloid receptor ligands and their use in treatments Amgen Inc. (US) 2007-08-15 — — EP disclosed
EP-1603905-A1 VANILLOID RECEPTOR LIGANDS AND THEIR USE IN TREATMENTS AMGEN INC. (US) 2005-12-14 — — EP disclosed
WO-2004072068-A1 VANILLOID RECEPTOR LIGANDS AND THEIR USE IN TREATMENTS AMGEN INC. (US) 2004-08-26 — — WO disclosed
US-20040157845-A1 Vanilloid receptor ligands and their use in treatments AMGEN INC. 2004-08-12 — — 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-20040157845-A1 Vanilloid receptor ligands and their use in treatments TRPV1, TRPV2, TRPV3 TAAR1 428/4885MEN1 3438/4885KMT2A 3812/4885

“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