SCHEMBL2450334

SCHEMBL2450334

Clc1ccc(OCOc2[c]cccc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SCN4A P35499 2/20 0.39
DRD2 P14416 1/20 0.39
DRD4 P21917 1/20 0.39
DRD3 P35462 1/20 0.39
KCNH2 Q12809 3/20 0.37
PPARG P37231 2/20 0.36
PPARA Q07869 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
TAAR1 Q96RJ0 1/20 0.35
MAOB P27338 2/20 0.35
APP P05067 1/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
GPR84 Q9NQS5 1/20 0.35
POLB P06746 1/20 0.35
TDP1 Q9NUW8 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
SCHEMBL2450359 0.86 DRD4 (0.46) SCN4ADRD2DRD4DRD3KCNH2
SCHEMBL6538591 0.85 KCNA3 (0.41) DRD2DRD4DRD3KCNH2TAAR1
SCHEMBL7862622 0.83 DRD2 (0.47) DRD2DRD4DRD3KCNH2
SCHEMBL1532027 0.78 MAOA (0.42) L3MBTL1MAOBNPC1RAB9ASMN1; SMN2
SCHEMBL1907545 0.77 MAOB (0.43) L3MBTL1MAOBAPPNPC1RAB9A
SCHEMBL4314683 0.77 DRD2 (0.58) SCN4ADRD2DRD4DRD3KCNH2
SCHEMBL1003652 0.77 MAOB (0.50) SCN4ADRD2DRD4DRD3KCNH2
SCHEMBL9031404 0.77
SCHEMBL2150076 0.75
SCHEMBL4827804 0.75 GPR84 (0.47) TAAR1MAOBNPC1RAB9AGPR84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8022072-B2 Azolylmethylidenehydrazine derivative and use thereof KAKEN PHARMACEUTICAL CO., LTD. (JP) 2011-09-20 US disclosed
US-20100190754-A1 AZOLYLMETHYLIDENEHYDRAZINE DERIVATIVE AND USE THEREOF KAKEN PHARMACEUTICAL CO., LTD. (JP) 2010-07-29 US disclosed
EP-2168951-A1 AZOLYLMETHYLENEHYDRAZINE DERIVATIVE AND USE THEREOF KAKEN PHARMACEUTICAL CO., LTD. (JP) 2010-03-31 EP 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-20100190754-A1 AZOLYLMETHYLIDENEHYDRAZINE DERIVATIVE AND USE THEREOF ARSA, AHR, HRH2 SCN4A 1736/4885DRD2 409/4885DRD4 1104/4885

“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.