SCHEMBL3590038

SCHEMBL3590038

CC(C)(C)OC(=O)N1CCC(Nc2ncc3cnn(-c4ccc(OCc5ccccc5)c5c4CCCC5)c3n2)CC1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 4/20 0.46
LMNA P02545 4/20 0.41
TP53 P04637 4/20 0.41
POLB P06746 1/20 0.41
MAPT P10636 1/20 0.41
TLR9 Q9NR96 2/20 0.41
USP30 Q70CQ3 1/20 0.41
YAP1 P46937 2/20 0.40
THRB P10828 1/20 0.40
BRD4 O60885 1/20 0.40
GPR119 Q8TDV5 1/20 0.40
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL3587627 0.75 CDK4 (0.35) LMNA
SCHEMBL3775260 0.73 USP30 (0.67) POLBMAPTUSP30GPR119
SCHEMBL3586266 0.72 AURKA (0.42)
SCHEMBL31299817 0.71 MERTK (0.45) LMNAMAPTUSP30GPR119
SCHEMBL31299833 0.71 MERTK (0.45) LMNAMAPTUSP30GPR119
SCHEMBL2418581 0.70 PRMT5 (0.68) PRMT5USP30YAP1GPR119
SCHEMBL23360351 0.69 PRMT5 (0.51) PRMT5POLBMAPTTLR9USP30
SCHEMBL7043443 0.69 ALDH1A1 (0.69) PRMT5MAPTYAP1GPR119
SCHEMBL1121386 0.68 PRMT5 (0.51) PRMT5MAPTTLR9YAP1THRB
SCHEMBL26483782 0.68 YAP1 (0.47) PRMT5TP53TLR9YAP1THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100190787-A1 Modulators of Mitotic Kinases BIOGEN IDEC MA INC 2010-07-29 US claimed
EP-2108019-A2 1-H-PYRAZOLO[3,4B]PYRIMIDINE DERIVATIVES AND THEIR USE AS MODULATORS OF MITOTIC KINASES Biogen Idec MA, Inc. (US) 2009-10-14 EP claimed
WO-2008094575-A2 1-H-PYRAZOLO(3,4B)PYRIMIDINE DERIVATIVES AND THEIR USE AS MODULATORS OF MITOTIC KINASES BIOGEN IDEC MA INC. (US) 2008-08-07 WO claimed
US-20100190787-A1 Modulators of Mitotic Kinases BIOGEN IDEC MA INC 2010-07-29 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-20100190787-A1 Modulators of Mitotic Kinases CDK1, BUB1, BUB1B PRMT5 1628/4885LMNA 1116/4885TP53 190/4885

“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.