SCHEMBL13145355

SCHEMBL13145355

CC(C)OCC(O)CN1CCCCC1

nearest known ligand 0.69

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.67
KMT2A Q03164 3/20 0.59
MEN1 O00255 2/20 0.59
ATM Q13315 2/20 0.54
CYP2D6 P10635 2/20 0.53
CYP2C19 P33261 1/20 0.53
POLB P06746 2/20 0.51
KDM4E B2RXH2 2/20 0.51
TSHR P16473 2/20 0.50
MAPT P10636 1/20 0.50
HIF1A Q16665 1/20 0.50
ACE2 Q9BYF1 1/20 0.49
ABCB1 P08183 4/20 0.48
ADRB2 P07550 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
SCHEMBL13145353 0.98 SMN1; SMN2 (0.69) SMN1; SMN2KMT2AMEN1ATMCYP2D6
SCHEMBL21743267 0.98 SMN1; SMN2 (0.69) SMN1; SMN2KMT2AMEN1ATMCYP2D6
SCHEMBL21941854 0.98 SMN1; SMN2 (0.69) SMN1; SMN2KMT2AMEN1ATMCYP2D6
SCHEMBL21743274 0.94 SMN1; SMN2 (0.69) SMN1; SMN2KMT2AMEN1ATMCYP2D6
SCHEMBL18747350 0.94 SMN1; SMN2 (0.69) SMN1; SMN2KMT2AMEN1ATMCYP2D6
SCHEMBL23641970 0.94 SMN1; SMN2 (0.69) SMN1; SMN2KMT2AMEN1ATMCYP2D6
SCHEMBL4446649 0.90 SMN1; SMN2 (0.73) SMN1; SMN2KMT2AMEN1ATMPOLB
SCHEMBL3966966 0.90 SMN1; SMN2 (0.73) SMN1; SMN2KMT2AMEN1ATMPOLB
SCHEMBL3970208 0.90 SMN1; SMN2 (0.73) SMN1; SMN2KMT2AMEN1ATMPOLB
SCHEMBL25493043 0.83 SMN1; SMN2 (0.65) SMN1; SMN2KMT2AMEN1POLBKDM4E

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
US-7795440-B2 N-substituted tricyclic 1-aminopyrazoles as inhibitors for the treatment of cell proliferative disorders JANSSEN PHARMACEUTICA NV (BE) 2010-09-14 US disclosed
US-20070142305-A1 N-substituted tricyclic 1-aminopyrazoles as inhibitors for the treatment of cell proliferative disorders HO CHIH Y 2007-06-21 US disclosed
US-7196110-B2 N-substituted tricyclic 3-aminopyrazoles as inhibitors for the treatment of cell proliferative disorders JANSSEN PHAMACEUTICA N.V. (BE) 2007-03-27 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-20070142305-A1 N-substituted tricyclic 1-aminopyrazoles as inhibitors for the treatment of cell proliferative disorders PDGFRA, PDGFRB, PDGFA SMN1; SMN2 3954/4885KMT2A 2557/4885MEN1 2796/4885

“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.