SCHEMBL4089600

SCHEMBL4089600

OB(O)c1ccc2cc(OCCN3CCCC3)ccc2c1

nearest known ligand 0.67

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.56
HRH3 Q9Y5N1 5/20 0.53
MAOB P27338 1/20 0.52
PSMB1 P20618 5/20 0.50
PSMB5 P28074 5/20 0.50
PSMB2 P49721 5/20 0.50
KDM4E B2RXH2 2/20 0.50
KMT2A Q03164 1/20 0.50
POLB P06746 1/20 0.50

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
SCHEMBL4083675 0.99 HRH3 (0.56) LTA4HHRH3MAOBPSMB1PSMB5
SCHEMBL2966068 0.86 PSMB1 (0.61) LTA4HHRH3PSMB1PSMB5PSMB2
SCHEMBL29953914 0.85 PSMB1 (0.64) LTA4HHRH3PSMB1PSMB5PSMB2
SCHEMBL3125089 0.85 PSMB1 (0.64) LTA4HHRH3PSMB1PSMB5PSMB2
SCHEMBL29951665 0.84 LTA4H (0.61) LTA4HKDM4EPOLB
SCHEMBL29957034 0.83 BACE1 (0.62) LTA4HHRH3KDM4EPOLB
SCHEMBL29957497 0.83 BACE1 (0.62) LTA4HHRH3KDM4EPOLB
SCHEMBL4088546 0.80 MAOB (0.47) HRH3MAOB
SCHEMBL30186207 0.79 HRH3 (0.81) LTA4HHRH3MAOB
SCHEMBL11151279 0.79 HRH3 (0.81) LTA4HHRH3MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2065383-A1 Indazole compounds and methods of use thereof as protein kinase inhibitors Signal Pharmaceuticals, Inc. (US) 2009-06-03 EP disclosed
US-20090099178-A1 INDAZOLE COMPOUNDS AND METHODS OF USE THEREOF BHAGWAT SHRIPAD S 2009-04-16 US disclosed
EP-1692128-A1 INDAZOLE COMPOUNDS AND METHODS OF USE THEREOF AS PROTEIN KINASE INHIBITORS Signal Pharmaceuticals LLC (US) 2006-08-23 EP disclosed
US-20060004043-A1 Indazole compounds and methods of use thereof BHAGWAT SHRIPAD S 2006-01-05 US disclosed
WO-2005051942-A1 INDAZOLE COMPOUNDS AND METHODS OF USE THEREOF AS PROTEIN KINASE INHIBITORS SIGNAL PHARMACEUTICALS, LLC (US) 2005-06-09 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 (2 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-20090099178-A1 INDAZOLE COMPOUNDS AND METHODS OF USE THEREOF WNT3, WNT3A, WNK3 LTA4H 2426/4885HRH3 2504/4885MAOB 3587/4885
US-20060004043-A1 Indazole compounds and methods of use thereof WNT3, WNT3A, WNK3 LTA4H 2448/4885HRH3 2769/4885MAOB 3738/4885

“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.