SCHEMBL7770903

SCHEMBL7770903

C[C@H]1CCCCN1C(N)=O

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.56
GAA P10253 2/20 0.56
CA12 O43570 1/20 0.47
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA7 P43166 1/20 0.47
CA9 Q16790 1/20 0.47
CA14 Q9ULX7 1/20 0.47
ALDH1A1 P00352 4/20 0.47
SMN1; SMN2 Q16637 1/20 0.45
POLB P06746 2/20 0.44
KMT2A Q03164 3/20 0.42
LMNA P02545 1/20 0.42
LIPE Q05469 1/20 0.42
MEN1 O00255 2/20 0.41
TSHR P16473 2/20 0.41

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
SCHEMBL2038510 1.00 HPGD (0.56) HPGDGAACA12CA1CA2
SCHEMBL9658993 0.93
SCHEMBL2314238 0.93
SCHEMBL16051303 0.84
SCHEMBL20054235 0.83 HPGD (0.53) HPGDGAACA12CA1CA2
SCHEMBL4028484 0.82 HPGD (0.60) HPGDGAACA12CA1CA2
SCHEMBL23581941 0.80 HPGD (0.50) HPGDGAACA12CA1CA2
SCHEMBL14439211 0.80 HPGD (0.58) HPGDGAACA12CA1CA2
SCHEMBL7888486 0.80 HPGD (0.58) HPGDGAACA12CA1CA2
SCHEMBL420108 0.80 HPGD (0.58) HPGDGAACA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0686698-B1 Biotechnological process for the production of cyclic S-alpha-aminocarboxylic acids and R-alpha-aminocarboxylic acid amides LONZA AG (CH) 2001-03-14 EP claimed
US-20180148452-A1 TOLL-LIKE RECEPTOR-7 AGONIST MEDSHINE DISCOVERY INC. (CN) 2018-05-31 US disclosed
US-20180148452-A1 TOLL-LIKE RECEPTOR-7 AGONIST MEDSHINE DISCOVERY INC. (CN) 2018-05-31 US disclosed
WO-2014195400-A1 KINASE INHIBITORS CHIESI FARMACEUTICI S.P.A. (IT) 2014-12-11 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-20180148452-A1 TOLL-LIKE RECEPTOR-7 AGONIST TLR7, TLR9, TLR1 HPGD 1528/4885GAA 1929/4885CA12 4689/4885

“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.