SCHEMBL12324924

SCHEMBL12324924

CCCCOC(=O)Cn1cnc2c(Cl)nc(NC(=O)OC(C)(C)C)nc21

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.38
P2RX7 Q99572 1/20 0.35
CCNE2 O96020 1/20 0.34
CCNE1 P24864 1/20 0.34
CDK2 P24941 1/20 0.34
CNR1 P21554 1/20 0.34
MTOR P42345 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33

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
SCHEMBL12072489 0.90 RAB9A (0.39) LMNAP2RX7CCNE2CCNE1CDK2
SCHEMBL14477481 0.83 RAB9A (0.46) P2RX7CCNE2CCNE1CDK2
SCHEMBL12324923 0.80 HSP90AB1 (0.47) LMNAHDAC1
SCHEMBL18331391 0.73 CDK2 (0.48) CCNE2CCNE1CDK2
SCHEMBL12072535 0.73 MTOR (0.53) MTORHDAC1HDAC2
SCHEMBL22412661 0.73 P2RX7 (0.55) LMNAP2RX7CCNE2CCNE1CDK2
SCHEMBL12072486 0.72 CCNE2 (0.38) LMNAP2RX7CCNE2CCNE1CDK2
SCHEMBL15499105 0.72 HDAC6 (0.39) HDAC1
SCHEMBL7852502 0.71 CDK5 (0.36) P2RX7CCNE2CCNE1CDK2
SCHEMBL20836970 0.70 ACHE (0.40) LMNACCNE2CCNE1CDK2MTOR

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-8653269-B2 Process for preparation of t-butoxycarbonylamine compounds NIPPON SODA CO., LTD. (JP) 2014-02-18 US disclosed
US-20130005981-A1 PROCESS FOR PREPARATION OF t-BUTOXYCARBONYLAMINE COMPOUNDS NIPPON SODA CO., LTD. (JP) 2013-01-03 US disclosed
WO-2011111705-A1 PROCESS FOR PREPARATION OF t-BUTOXYCARBONYLAMINE COMPOUNDS 日本曹達株式会社 (JP) 2011-09-15 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-20130005981-A1 PROCESS FOR PREPARATION OF t-BUTOXYCARBONYLAMINE COMPOUNDS BPGM, TST, BET1 LMNA 2253/4885P2RX7 4708/4885CCNE2 823/4885

“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.