SCHEMBL4091425

SCHEMBL4091425

CC1(C)OB(c2ccc3ccc(OCCN4CCCC4)cc3c2)OC1(C)C

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 5/20 0.48
MAOB P27338 2/20 0.47
KDM4E B2RXH2 3/20 0.47
LTA4H P09960 2/20 0.47
DRD3 P35462 1/20 0.43
ALDH1A1 P00352 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
PSMB1 P20618 3/20 0.42
PSMB5 P28074 3/20 0.42
PSMB2 P49721 2/20 0.42

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
SCHEMBL871366 0.86 LTA4H (0.54) HRH3KDM4ELTA4HALDH1A1PSMB1
SCHEMBL585479 0.85 PSMB1 (0.55) HRH3KDM4ELTA4HPSMB1PSMB5
SCHEMBL24364468 0.84 KDM4E (0.55) HRH3KDM4ELTA4HALDH1A1SMN1; SMN2
SCHEMBL4089555 0.82 LTA4H (0.46) HRH3MAOBKDM4ELTA4H
SCHEMBL4169739 0.82 LTA4H (0.46) HRH3MAOBKDM4ELTA4H
SCHEMBL18824777 0.80 HRH3 (0.56) HRH3
SCHEMBL4094975 0.79 HRH3 (0.46) HRH3MAOBKDM4ELTA4H
SCHEMBL237631 0.79 HRH3 (0.58) HRH3
SCHEMBL8443537 0.79 KDM4E (0.57) HRH3KDM4EALDH1A1SMN1; SMN2
SCHEMBL5780789 0.79 LPL (0.49) KDM4EALDH1A1SMN1; SMN2

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 HRH3 2504/4885MAOB 3587/4885KDM4E 3468/4885
US-20060004043-A1 Indazole compounds and methods of use thereof WNT3, WNT3A, WNK3 HRH3 2769/4885MAOB 3738/4885KDM4E 3359/4885

“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.