SCHEMBL14375342

SCHEMBL14375342

CC(=O)C(C)N1CCC(C)CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
ATM Q13315 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
NPC1 O15118 1/20 0.39
HSP90AA1 P07900 1/20 0.37
CYP3A4 P08684 1/20 0.36
ACHE P22303 1/20 0.35
HPGD P15428 2/20 0.35
POLB P06746 2/20 0.35
LIPE Q05469 1/20 0.35
KDM4E B2RXH2 1/20 0.34
USP2 O75604 1/20 0.34
HTT P42858 1/20 0.34
GAA P10253 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
PHGDH O43175 1/20 0.33
MGLL Q99685 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
SCHEMBL28787833 0.84 ALDH1A1 (0.48) ALDH1A1MEN1KMT2AATMNPSR1
SCHEMBL5132272 0.83 ALDH1A1 (0.47) ALDH1A1MEN1KMT2AATMNPSR1
SCHEMBL14227654 0.81
SCHEMBL14878189 0.81 ALDH1A1 (0.46) ALDH1A1MEN1KMT2AATMNPSR1
SCHEMBL23205721 0.78 ALDH1A1 (0.43) ALDH1A1MEN1KMT2AATMNPSR1
SCHEMBL12374970 0.78 HRH3 (0.53) ALDH1A1MEN1KMT2ACYP3A4KDM4E
SCHEMBL24011052 0.77 MEN1 (0.37) ALDH1A1MEN1KMT2AATMNPSR1
SCHEMBL13255632 0.77 ATM (0.42) ALDH1A1MEN1KMT2AATMNPC1
SCHEMBL859733 0.77 ATM (0.42) ALDH1A1MEN1KMT2AATMNPC1
SCHEMBL24089738 0.76 MEN1 (0.47) ALDH1A1MEN1KMT2AATMNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070244133-A1 Thienopyrimidines and Thiazolopyrimidines for Use in Medicine ASTRAZENECA AB (SE) 2007-10-18 US disclosed
US-20070244133-A1 Thienopyrimidines and Thiazolopyrimidines for Use in Medicine ASTRAZENECA AB (SE) 2007-10-18 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-20070244133-A1 Thienopyrimidines and Thiazolopyrimidines for Use in Medicine CXCR4, CXCR1, CXCR3 ALDH1A1 683/4885MEN1 4261/4885KMT2A 4292/4885

“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.