SCHEMBL3799680

SCHEMBL3799680

CC1CN(c2ccccc2N)CC(C)N1C(=O)OC(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.46
USP2 O75604 1/20 0.46
GAA P10253 1/20 0.46
KMT2A Q03164 1/20 0.46
HDAC1 Q13547 2/20 0.44
HSD11B1 P28845 2/20 0.43
SMARCA2 P51531 2/20 0.42
SMARCA4 P51532 2/20 0.42
PBRM1 Q86U86 2/20 0.42
BCHE P06276 1/20 0.42
KDM1A O60341 1/20 0.41
ADRA2C P18825 1/20 0.41
GPR119 Q8TDV5 2/20 0.40
KEAP1 Q14145 1/20 0.40
SCN9A Q15858 1/20 0.39
MAP4K4 O95819 1/20 0.39
RORC P51449 1/20 0.38
ABCB1 P08183 1/20 0.38
NAMPT P43490 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
SCHEMBL31082592 0.82 CYP11B2 (0.43) MEN1KMT2ABCHEGPR119SCN9A
SCHEMBL21336726 0.81 GPR119 (0.56) GPR119RORCABCB1NAMPT
SCHEMBL3798458 0.80 HTR1A (0.44) MEN1KMT2AHSD11B1BCHEGPR119
SCHEMBL29147935 0.79 MAPT (0.46) MEN1GAAKMT2AHDAC1HSD11B1
SCHEMBL29147937 0.79 MAPT (0.46) MEN1GAAKMT2AHDAC1HSD11B1
SCHEMBL23246119 0.79 MAPT (0.46) MEN1GAAKMT2AHDAC1HSD11B1
SCHEMBL29532374 0.79 MAPT (0.46) MEN1GAAKMT2AHDAC1HSD11B1
SCHEMBL6073574 0.78 GPR119 (0.43) MEN1KMT2AHDAC1HSD11B1GPR119
SCHEMBL5726247 0.78 GPR119 (0.43) MEN1KMT2AHDAC1HSD11B1GPR119
SCHEMBL5782035 0.78 GPR119 (0.46) ADRA2CGPR119MAP4K4

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-20100143341-A1 THIENOPYRIMIDINES FOR PHARMACEUTICAL COMPOSITIONS DEVELOGEN AKTIENGESELLSCHAFT (DE) 2010-06-10 US disclosed
EP-1899353-A1 THIENOPYRIMIDINES FOR PHARMACEUTICAL COMPOSITIONS DeveloGen Aktiengesellschaft (DE) 2008-03-19 EP disclosed
WO-2006136402-A1 THIENOPYRIMIDINES FOR PHARMACEUTICAL COMPOSITIONS DEVELOGEN AKTIENGESELLSCHAFT (DE) 2006-12-28 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-20100143341-A1 THIENOPYRIMIDINES FOR PHARMACEUTICAL COMPOSITIONS DTYMK, CMPK1, PDXK MEN1 1106/4885USP2 4213/4885GAA 2219/4885

“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.