SCHEMBL1204657

SCHEMBL1204657

CCOC(=O)n1nc2c(c1NC(=O)C1CC1c1ccccc1)CN(C(=O)Cl)C2(C)C

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
HTT P42858 2/20 0.39
LMNA P02545 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
ALDH1A1 P00352 2/20 0.39
NAMPT P43490 1/20 0.39
GAA P10253 1/20 0.39
DEGS1 O15121 2/20 0.38
PTGDR2 Q9Y5Y4 2/20 0.38
TCF4 P15884 1/20 0.36
CTNNB1 P35222 1/20 0.36
SIGMAR1 Q99720 1/20 0.36
HDAC4 P56524 1/20 0.36
ROCK2 O75116 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
SCHEMBL1204655 1.00 MEN1 (0.40) MEN1KMT2AHTTLMNASMN1; SMN2
SCHEMBL1204616 0.90 DEGS1 (0.38) MEN1KMT2AHTTLMNASMN1; SMN2
SCHEMBL1204617 0.90 DEGS1 (0.38) MEN1KMT2AHTTLMNASMN1; SMN2
SCHEMBL12879122 0.85 MEN1 (0.41) MEN1KMT2AHTTLMNASMN1; SMN2
SCHEMBL1205765 0.83 ALDH1A1 (0.41) HTTSMN1; SMN2ALDH1A1GAA
SCHEMBL1205814 0.82 GAA (0.37) KMT2AHTTLMNAALDH1A1GAA
SCHEMBL1204680 0.81 SMN1; SMN2 (0.36) KMT2ALMNASMN1; SMN2ALDH1A1GAA
SCHEMBL1204649 0.81 ALDH1A1 (0.36) KMT2AHTTLMNASMN1; SMN2ALDH1A1
SCHEMBL1205740 0.80 RAB9A (0.40) SMN1; SMN2ALDH1A1GAA
SCHEMBL12879130 0.80 MEN1 (0.34) MEN1KMT2AALDH1A1GAA

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
EP-1979356-B1 CARBONYLAMINO PYRROLOPYRAZOLES, POTENT KINASE INHIBITORS PFIZER PROD INC (US) 2013-09-18 EP disclosed
US-7884117-B2 Protein kinase inhibitors such as (S)-2-(methylamino)-1-phenylethyl 3-(4-fluorobenzamido)-6,6-dimethylpyrrolo[3,4-c]pyrazole-5(1H,4H,6H)-carboxylate, used for the treatment of abnormal cell growth in mammals; antiproliferative agents PFIZER INC. (US) 2011-02-08 US disclosed
US-20090318440-A1 CARBONYLAMINO PYRROLOPYRAZOLES, POTENT KINASE INHIBITORS PFIZER INC. 2009-12-24 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-20090318440-A1 CARBONYLAMINO PYRROLOPYRAZOLES, POTENT KINASE INHIBITORS PAK4, PAK5, PAK3 MEN1 2408/4885KMT2A 2472/4885HTT 4160/4885

“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.