SCHEMBL1356255

SCHEMBL1356255

CC(C)(C)N[C@H]1CCN(C(=O)O)C[C@H]1F

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.38
USP30 Q70CQ3 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
VNN1 O95497 2/20 0.31
SSTR4 P31391 2/20 0.31
SSTR1 P30872 1/20 0.31
F2R P25116 1/20 0.31
JAK3 P52333 2/20 0.30
ALDH1A1 P00352 1/20 0.30
GSK3B P49841 1/20 0.30
DYRK1A Q13627 1/20 0.30

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
SCHEMBL23086759 1.00 LMNA (0.38) LMNAUSP30SMN1; SMN2VNN1SSTR4
SCHEMBL16470712 1.00 LMNA (0.38) LMNAUSP30SMN1; SMN2VNN1SSTR4
SCHEMBL17747852 1.00 LMNA (0.38) LMNAUSP30SMN1; SMN2VNN1SSTR4
SCHEMBL22441066 0.87 LMNA (0.38) LMNAUSP30SMN1; SMN2JAK3ALDH1A1
SCHEMBL22441070 0.87 LMNA (0.38) LMNAUSP30SMN1; SMN2JAK3ALDH1A1
SCHEMBL23130508 0.87 LMNA (0.38) LMNAUSP30SMN1; SMN2JAK3ALDH1A1
SCHEMBL1437707 0.82 LMNA (0.39) LMNASMN1; SMN2ALDH1A1
SCHEMBL26963364 0.81 GSK3B (0.38) LMNAUSP30SMN1; SMN2F2RJAK3
SCHEMBL25339588 0.81 GSK3B (0.38) LMNAUSP30SMN1; SMN2F2RJAK3
SCHEMBL26963314 0.81 GSK3B (0.38) LMNAUSP30SMN1; SMN2F2RJAK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2367800-B9 SUBSTITUTED PYRIMIDINES FOR THE TREATMENT OF DISEASES SUCH AS CANCER IPHARMA H K LTD (HK) 2021-10-20 EP disclosed
EP-2367800-B1 SUBSTITUTED PYRIMIDINES FOR THE TREATMENT OF DISEASES SUCH AS CANCER BOEHRINGER INGELHEIM INT (DE) 2018-02-28 EP disclosed
US-20150376141-A1 NEW COMPOUNDS BOEHRINGER INGELHEIM INT (DE) 2015-12-31 US disclosed
US-20110288071-A1 SUBSTITUTED PYRIMIDINES FOR THE TREATMENT OF DISEASES SUCH AS CANCER BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-11-24 US disclosed
EP-2367800-A2 NEW COMPOUNDS Boehringer Ingelheim International GmbH (DE) 2011-09-28 EP 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 (2 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-20150376141-A1 NEW COMPOUNDS CCNA1, MKI67, CCNT1 LMNA 209/4885USP30 4572/4885SMN1; SMN2 381/4885
US-20110288071-A1 SUBSTITUTED PYRIMIDINES FOR THE TREATMENT OF DISEASES SUCH AS CANCER TYMP, HPRT1, TYMS LMNA 1415/4885USP30 4300/4885SMN1; SMN2 504/4885

“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.