SCHEMBL2497157

SCHEMBL2497157

COc1ccccc1-c1cccc(-n2cnc(C(=O)Cl)c2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 1/20 0.46
GRM5 P41594 1/20 0.43
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
PTPN5 P54829 1/20 0.40
SCN9A Q15858 5/20 0.40
TUBB4A P04350 3/20 0.40
TUBB P07437 3/20 0.40
TUBA3C P0DPH7 3/20 0.40
TUBA1B P68363 3/20 0.40
TUBA4A P68366 3/20 0.40
TUBB4B P68371 3/20 0.40
TUBB3 Q13509 3/20 0.40
TUBB2A Q13885 3/20 0.40
TUBB8 Q3ZCM7 3/20 0.40
TUBA3E Q6PEY2 3/20 0.40
TUBA1A Q71U36 3/20 0.40
TUBA1C Q9BQE3 3/20 0.40
TUBB6 Q9BUF5 3/20 0.40
TUBB2B Q9BVA1 3/20 0.40

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
SCHEMBL1886079 0.90 HTR7 (0.46) HTR7GRM5SCN9ATUBB4ATUBB
SCHEMBL2498495 0.89 CTSA (0.43) MAOAMAOBSCN9ATUBB4ATUBB
SCHEMBL2495295 0.87 HTR7 (0.44) HTR7GRM5TUBB4ATUBBTUBA3C
SCHEMBL2502816 0.86 GRM5 (0.46) HTR7GRM5MAOAMAOBPTPN5
SCHEMBL2501040 0.86 SCN9A (0.57) GRM5SCN9ASCN10A
SCHEMBL2495406 0.85 GRM5 (0.48) HTR7GRM5MAOAMAOBTUBB4A
SCHEMBL1882075 0.85 NOTUM (0.55) HTR7GRM5SCN9A
SCHEMBL2495560 0.85 HTR7 (0.42) HTR7GRM5MAOAMAOBPTPN5
SCHEMBL2501083 0.84 TUBB4A (0.44) HTR7GRM5MAOAMAOBSCN9A
SCHEMBL2497665 0.84 TUBB4A (0.46) HTR7GRM5MAOAMAOBTUBB4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8030339-B2 Imidazole derivatives for the treatment of anxiety and related diseases NEUROSEARCH A/S (DK) 2011-10-04 US disclosed
US-20090233929-A1 Imidazole Derivatives for the Treatment of Anxiety and Related Diseases NEUROSEARCH A/S (DK) 2009-09-17 US disclosed
EP-1937649-A1 IMIDAZOLE DERIVATIVES FOR THE TREATMENT OF ANXIETY AND RELATED DISEASES NEUROSEARCH A/S (DK) 2008-07-02 EP disclosed
WO-2007042546-A1 IMIDAZOLE DERIVATIVES FOR THE TREATMENT OF ANXIETY AND RELATED DISEASES NEUROSEARCH A/S (DK) 2007-04-19 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-20090233929-A1 Imidazole Derivatives for the Treatment of Anxiety and Related Diseases GABBR1, GABRB2, GABRB3 HTR7 95/4885GRM5 46/4885MAOA 100/4885

“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.