SCHEMBL190343

SCHEMBL190343

CN(C)Cc1cc(-c2ccc(OCc3ccccc3)cc2)no1

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.62
SMN1; SMN2 Q16637 5/20 0.62
L3MBTL1 Q9Y468 5/20 0.62
NPC1 O15118 5/20 0.62
TDP1 Q9NUW8 3/20 0.62
MAPT P10636 3/20 0.62
MEN1 O00255 2/20 0.60
KMT2A Q03164 2/20 0.60
CXCR1 P25024 3/20 0.54
POLB P06746 3/20 0.51
HPGD P15428 1/20 0.49
ENPP3 O14638 1/20 0.49
ENPP1 P22413 1/20 0.49
PTGS1 P23219 2/20 0.48
PTGS2 P35354 2/20 0.48
SMPD1 P17405 1/20 0.47

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
SCHEMBL189501 0.88 RAB9A (0.59) RAB9ASMN1; SMN2L3MBTL1NPC1TDP1
SCHEMBL189648 0.85 RAB9A (0.54) RAB9ASMN1; SMN2L3MBTL1NPC1TDP1
SCHEMBL190599 0.83 RAB9A (0.64) RAB9ASMN1; SMN2L3MBTL1NPC1TDP1
SCHEMBL189559 0.83 NOTUM (0.66) RAB9ASMN1; SMN2L3MBTL1NPC1TDP1
SCHEMBL190469 0.83 NOTUM (0.66) RAB9ASMN1; SMN2L3MBTL1NPC1TDP1
SCHEMBL20031303 0.82 NOTUM (0.62) RAB9ASMN1; SMN2L3MBTL1NPC1TDP1
SCHEMBL190134 0.82 RAB9A (0.58) RAB9ASMN1; SMN2L3MBTL1NPC1TDP1
SCHEMBL979239 0.80 SMPD1 (0.44) SMPD1
SCHEMBL14707191 0.80 RAB9A (0.61) RAB9ASMN1; SMN2L3MBTL1NPC1TDP1
SCHEMBL189013 0.80 RAB9A (0.61) RAB9ASMN1; SMN2L3MBTL1NPC1TDP1

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
EP-2401263-A2 SUBSTITUTED AZOLE DERIVATIVES, PHARMACEUTICAL COMPOSITION CONTAINING THE DERIVATIVES, AND METHOD FOR TREATING PARKINSON'S DISEASE USING THE SAME SK Biopharmaceuticals Co., Ltd. (KR) 2012-01-04 EP claimed
US-20110301150-A1 SUBSTITUTED AZOLE DERIVATIVES, PHARMACEUTICAL COMPOSITION CONTAINING THE DERIVATIVES, AND METHOD FOR TREATING PARKINSON'S DISEASE USING THE SAME SK BIOPHARMACEUTICALS CO., LTD. 2011-12-08 US claimed
WO-2010098600-A2 SUBSTITUTED AZOLE DERIVATIVES, PHARMACEUTICAL COMPOSITION CONTAINING THE DERIVATIVES, AND METHOD FOR TREATING PARKINSON'S DISEASE USING THE SAME SK HOLDINGS CO., LTD. (KR) 2010-09-02 WO claimed
EP-2401263-B1 SUBSTITUTED AZOLE DERIVATIVES, PHARMACEUTICAL COMPOSITION CONTAINING THE DERIVATIVES, AND METHOD FOR TREATING PARKINSON'S DISEASE USING THE SAME SK BIOPHARMACEUTICALS CO LTD (KR) 2016-02-17 EP disclosed
US-8828992-B2 Substituted azole derivatives, pharmaceutical composition containing the derivatives, and method for treating Parkinson's disease using the same SK BIOPHARMACEUTICALS CO., LTD. (KR) 2014-09-09 US disclosed
EP-2401263-A2 SUBSTITUTED AZOLE DERIVATIVES, PHARMACEUTICAL COMPOSITION CONTAINING THE DERIVATIVES, AND METHOD FOR TREATING PARKINSON'S DISEASE USING THE SAME SK Biopharmaceuticals Co., Ltd. (KR) 2012-01-04 EP disclosed
US-20110301150-A1 SUBSTITUTED AZOLE DERIVATIVES, PHARMACEUTICAL COMPOSITION CONTAINING THE DERIVATIVES, AND METHOD FOR TREATING PARKINSON'S DISEASE USING THE SAME SK BIOPHARMACEUTICALS CO., LTD. 2011-12-08 US disclosed
WO-2010098600-A2 SUBSTITUTED AZOLE DERIVATIVES, PHARMACEUTICAL COMPOSITION CONTAINING THE DERIVATIVES, AND METHOD FOR TREATING PARKINSON'S DISEASE USING THE SAME SK HOLDINGS CO., LTD. (KR) 2010-09-02 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-20110301150-A1 SUBSTITUTED AZOLE DERIVATIVES, PHARMACEUTICAL COMPOSITION CONTAINING THE DERIVATIVES, AND METHOD FOR TREATING PARKINSON'S DISEASE USING THE SAME MAOB, MAOA, PARK7 RAB9A 1245/4885SMN1; SMN2 268/4885L3MBTL1 4729/4885

“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.