SCHEMBL14088204

SCHEMBL14088204

CC(C)n1cnc2c(Nc3ccc(N4CCOCC4)cc3)nc(Oc3cccc4ccccc34)nc21

nearest known ligand 0.71

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SCTR P47872 9/20 0.71
SMO Q99835 1/20 0.71
EGFR P00533 5/20 0.46
CDK1 P06493 2/20 0.46
PLK4 O00444 1/20 0.43
CCNE2 O96020 1/20 0.43
CCNE1 P24864 1/20 0.43
CDK2 P24941 1/20 0.43
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
MAPT P10636 1/20 0.42
MAPK1 P28482 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 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
SCHEMBL14075698 0.87 SCTR (0.72) SCTRSMOPLK4KDM4EMEN1
SCHEMBL14075696 0.84 SCTR (0.98) SCTRSMO
SCHEMBL14075697 0.84 SCTR (0.95) SCTRSMO
Purmorphamine SCHEMBL29358352 0.83 SCTR (1.00) SCTRSMO
Purmorphamine SCHEMBL1548273 0.83 SCTR (1.00) SCTRSMO
SCHEMBL14075692 0.83 SCTR (0.74) SCTRSMOPLK4
SCHEMBL14075707 0.83 SCTR (0.67) SCTRSMOPLK4KDM4EMEN1
SCHEMBL14075699 0.81 SCTR (0.65) SCTRSMOPLK4KDM4EMEN1
SCHEMBL14075700 0.81 SCTR (0.76) SCTRSMOPLK4
SCHEMBL31488323 0.80 SCTR (0.63) SCTRSMOPLK4KDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080214541-A1 COMPOSITIONS AND METHODS FOR INDUCING OSTEOGENESIS IRM LLC (BM) 2008-09-04 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-20080214541-A1 COMPOSITIONS AND METHODS FOR INDUCING OSTEOGENESIS BMP2, BMP4, BMP6 SCTR 3728/4885SMO 226/4885EGFR 2450/4885

“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.