SCHEMBL3067896

SCHEMBL3067896

Clc1ccc(/C=N/CCc2ccccc2)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.70
ALDH1A1 P00352 2/20 0.59
GAA P10253 2/20 0.59
G6PC1 P35575 1/20 0.54
CA1 P00915 6/20 0.53
CA2 P00918 6/20 0.53
CA9 Q16790 5/20 0.53
CA12 O43570 4/20 0.53
SHBG P04278 1/20 0.51
MAPT P10636 4/20 0.50
MAPK1 P28482 1/20 0.50
CA7 P43166 1/20 0.49
BCHE P06276 2/20 0.46
ACHE P22303 2/20 0.46
BACE1 P56817 2/20 0.46
GRIN1 Q05586 1/20 0.45
GRIN2B Q13224 1/20 0.45
NLRP3 Q96P20 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HTT P42858 1/20 0.43

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
SCHEMBL3067898 1.00 TAAR1 (0.70) TAAR1ALDH1A1GAAG6PC1CA1
SCHEMBL8418689 0.87 TAAR1 (0.76) TAAR1ALDH1A1GAAG6PC1CA1
SCHEMBL2464453 0.87 TAAR1 (0.76) TAAR1ALDH1A1GAAG6PC1CA1
SCHEMBL14676823 0.83 TAAR1 (0.57) TAAR1ALDH1A1GAACA1CA2
SCHEMBL14676824 0.83 TAAR1 (0.57) TAAR1ALDH1A1GAACA1CA2
SCHEMBL8571159 0.82 TAAR1 (0.70) TAAR1ALDH1A1GAACA1CA2
SCHEMBL19233523 0.81 G6PC1 (0.57) TAAR1ALDH1A1GAAG6PC1CA1
SCHEMBL8543158 0.81 G6PC1 (0.57) TAAR1ALDH1A1GAAG6PC1CA1
SCHEMBL30342907 0.81 TAAR1 (0.58) TAAR1ALDH1A1GAACA1CA2
SCHEMBL10949573 0.80 MAOB (0.56) TAAR1ALDH1A1G6PC1CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8476297-B2 TRP-M8 receptor ligands and their use in treatments AMGEN INC. (US) 2013-07-02 US disclosed
US-8476297-B2 TRP-M8 receptor ligands and their use in treatments AMGEN INC. (US) 2013-07-02 US disclosed
US-8476297-B2 TRP-M8 receptor ligands and their use in treatments AMGEN INC. (US) 2013-07-02 US disclosed
US-20100261728-A1 TRP-M8 RECEPTOR LIGANDS AND THEIR USE IN TREATMENTS AMGEN INC. (US) 2010-10-14 US disclosed
US-20100261728-A1 TRP-M8 RECEPTOR LIGANDS AND THEIR USE IN TREATMENTS AMGEN INC. (US) 2010-10-14 US disclosed
US-20100261728-A1 TRP-M8 RECEPTOR LIGANDS AND THEIR USE IN TREATMENTS AMGEN INC. (US) 2010-10-14 US disclosed
WO-2009073203-A1 TRP-M8 RECEPTOR LIGANDS AND THEIR USE IN TREATMENTS AMGEN INC. (US) 2009-06-11 WO disclosed
WO-2009073203-A1 TRP-M8 RECEPTOR LIGANDS AND THEIR USE IN TREATMENTS AMGEN INC. (US) 2009-06-11 WO 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-20100261728-A1 TRP-M8 RECEPTOR LIGANDS AND THEIR USE IN TREATMENTS TRPV1, TRPM8, TRPV2 TAAR1 236/4885ALDH1A1 3439/4885GAA 1559/4885

“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.