SCHEMBL1962901

SCHEMBL1962901

Oc1cc2nnnn2c2ccc(OCc3ccccc3)cc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.43
MEN1 O00255 2/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
KMT2A Q03164 2/20 0.43
HPGD P15428 1/20 0.43
TSHR P16473 1/20 0.43
LMNA P02545 2/20 0.42
CYP1A2 P05177 1/20 0.42
PTGS1 P23219 1/20 0.42
SLC6A2 P23975 1/20 0.42
CYP2C19 P33261 1/20 0.42
PTGS2 P35354 1/20 0.42
SLC6A3 Q01959 1/20 0.42
HIF1A Q16665 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
AS3MT Q9HBK9 1/20 0.41
ALDH1A1 P00352 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ALOX5 P09917 1/20 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
SCHEMBL1962121 0.75 CTSV (0.42) MAOBMEN1NPC1RAB9AKMT2A
SCHEMBL27751714 0.71 PPARD (0.54) MAOBLMNACYP1A2PTGS1SLC6A2
SCHEMBL9259645 0.71 MEN1 (0.65) MAOBMEN1NPC1RAB9AKMT2A
SCHEMBL3614904 0.69 LMNA (0.47) MAOBLMNACYP1A2PTGS1SLC6A2
SCHEMBL22919631 0.68 MAOB (0.56) MAOBMEN1NPC1RAB9AKMT2A
SCHEMBL8599201 0.68 LMNA (0.68) MAOBMEN1RAB9AKMT2ALMNA
SCHEMBL3645761 0.67 MAOB (0.51) MAOBMEN1NPC1RAB9AKMT2A
SCHEMBL1486580 0.66 IP6K1 (0.56) MAOBNPC1RAB9ALMNACYP1A2
SCHEMBL5704429 0.66 ALOX5 (0.60) MAOBMEN1NPC1KMT2ALMNA
SCHEMBL38662923 0.66 ALOX5 (0.65) MAOBMEN1NPC1KMT2ALMNA

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
EP-1658076-B1 ARYLOXY AND ARYLALKYLENEOXY SUBSTITUTED IMIDAZOQUINOLINES 3M INNOVATIVE PROPERTIES CO (US) 2013-03-06 EP disclosed
US-8263594-B2 Aryloxy and arylalkyleneoxy substituted imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY (US) 2012-09-11 US disclosed
US-20110144099-A1 ARYLOXY AND ARYLALKYLENEOXY SUBSTITUTED IMIDAZOQUINOLINES 3M INNOVATIVE PROPERTIES COMPANY 2011-06-16 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-20110144099-A1 ARYLOXY AND ARYLALKYLENEOXY SUBSTITUTED IMIDAZOQUINOLINES IL2, IFNG, IRF3 MAOB 3039/4885MEN1 4631/4885NPC1 2205/4885

“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.