SCHEMBL589704

SCHEMBL589704

CN1CCC(Oc2cc[c]c(N)c2)CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 4/20 0.47
MAOA P21397 1/20 0.44
MAOB P27338 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
PARP1 P09874 1/20 0.40
CHEK2 O96017 1/20 0.37
LNPEP Q9UIQ6 1/20 0.36
TGFBR1 P36897 1/20 0.36
ACVR1 Q04771 1/20 0.36
HTR1D P28221 1/20 0.36
HTR1B P28222 1/20 0.36
KCNH2 Q12809 2/20 0.36
CHRM2 P08172 1/20 0.36
HTR1A P08908 1/20 0.36
ADRA2A P08913 1/20 0.36
CYP2D6 P10635 1/20 0.36
CHRM1 P11229 1/20 0.36
DRD1 P21728 1/20 0.36
SLC6A2 P23975 1/20 0.36
ADRA1A P35348 1/20 0.36

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
SCHEMBL27035448 0.85 ROCK1 (0.34) SLC6A2SLC6A3
SCHEMBL188648 0.77 HRH3 (0.63) HRH3MAOAMAOBSMN1; SMN2TGFBR1
SCHEMBL1645653 0.76 HRH3 (0.54) HRH3MAOAMAOBSMN1; SMN2PARP1
SCHEMBL374287 0.76 HRH3 (0.50) HRH3MAOAMAOBSMN1; SMN2HTR1D
SCHEMBL589550 0.76 MAOA (0.43) HRH3MAOAMAOBSMN1; SMN2PARP1
SCHEMBL188685 0.75 HRH3 (0.65) HRH3MAOAMAOBSMN1; SMN2CHEK2
Hydrochloric Acid SCHEMBL4492056 0.75 SMN1; SMN2 (0.52) HRH3MAOAMAOBSMN1; SMN2
SCHEMBL13091424 0.74 HRH3 (0.51) HRH3MAOAMAOBSMN1; SMN2PARP1
SCHEMBL20043816 0.74 HRH3 (0.51) HRH3MAOAMAOBSMN1; SMN2PARP1
SCHEMBL5540295 0.73 SLC6A2 (0.56) HRH3MAOAMAOBSMN1; SMN2SLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2120932-B1 INDAZOLE DERIVATIVES AS KINASE INHIBITORS FOR THE TREATMENT OF CANCER NERVIANO MEDICAL SCIENCES SRL (IT) 2014-07-09 EP disclosed
US-8114865-B2 Indazole derivatives as kinase inhibitors for the treatment of cancer NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2012-02-14 US disclosed
US-20100197665-A1 INDAZOLE DERIVATIVES AS KINASE INHIBITORS FOR THE TREATMENT OF CANCER NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2010-08-05 US disclosed
EP-2120932-A1 INDAZOLE DERIVATIVES AS KINASE INHIBITORS FOR THE TREATMENT OF CANCER Nerviano Medical Sciences S.r.l. (IT) 2009-11-25 EP disclosed
WO-2008074749-A9 INDAZOLE DERIVATIVES AS KINASE INHIBITORS FOR THE TREATMENT OF CANCER NERVIANO MEDICAL SCIENCES SRL (IT) 2009-05-07 WO disclosed
WO-2008074749-A1 INDAZOLE DERIVATIVES AS KINASE INHIBITORS FOR THE TREATMENT OF CANCER NERVIANO MEDICAL SCIENCES S.R.L. (IT) 2008-06-26 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-20100197665-A1 INDAZOLE DERIVATIVES AS KINASE INHIBITORS FOR THE TREATMENT OF CANCER MAP3K5, MAP3K19, MAP3K3 HRH3 3412/4885MAOA 2984/4885MAOB 2830/4885

“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.