SCHEMBL21458104

SCHEMBL21458104

Cc1sc2ncnc(N[C@@H]3CCN(Cc4ccccc4)C3)c2c1C

nearest known ligand 0.88

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.88
HTT P42858 3/20 0.88
SMN1; SMN2 Q16637 3/20 0.88
KMT2A Q03164 3/20 0.88
RAB9A P51151 2/20 0.88
RXFP1 Q9HBX9 2/20 0.88
MAPK1 P28482 2/20 0.88
LMNA P02545 1/20 0.63
NOD2 Q9HC29 1/20 0.63
DRD4 P21917 1/20 0.53
MAPT P10636 2/20 0.52
IRAK4 Q9NWZ3 1/20 0.52
HPGD P15428 1/20 0.49
CYP3A4 P08684 1/20 0.48
NSD2 O96028 1/20 0.47
SCN1A P35498 1/20 0.46
SCN8A Q9UQD0 1/20 0.46
BCHE P06276 2/20 0.46
ACHE P22303 2/20 0.46
BACE1 P56817 2/20 0.46

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
SCHEMBL21458102 1.00 MEN1 (0.88) MEN1HTTSMN1; SMN2KMT2ARAB9A
SCHEMBL21458101 1.00 MEN1 (0.88) MEN1HTTSMN1; SMN2KMT2ARAB9A
SCHEMBL12790000 0.94 MEN1 (1.00) MEN1HTTSMN1; SMN2KMT2ARAB9A
SCHEMBL21458107 0.89 MEN1 (0.70) MEN1HTTSMN1; SMN2KMT2ARAB9A
SCHEMBL16090511 0.80 MEN1 (0.74) MEN1HTTSMN1; SMN2KMT2ARAB9A
SCHEMBL18962385 0.79 MEN1 (0.72) MEN1HTTSMN1; SMN2KMT2ARAB9A
SCHEMBL1604211 0.78 MEN1 (0.71) MEN1HTTSMN1; SMN2KMT2ARAB9A
SCHEMBL12710494 0.78 MEN1 (0.71) MEN1HTTSMN1; SMN2KMT2ARAB9A
SCHEMBL1604026 0.77 LMNA (1.00) MEN1HTTSMN1; SMN2KMT2ARAB9A
SCHEMBL19317179 0.77 MEN1 (0.67) MEN1HTTSMN1; SMN2KMT2ARAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117757744-A Culture medium for enhancing T cell function and dryness and application thereof 中山大学 2024-03-26 CN claimed
US-11679111-B2 Fatty acid synthase inhibitors DUKE UNIVERSITY (US) 2023-06-20 US claimed
US-20210338676-A1 FATTY ACID SYNTHASE INHIBITORS DUKE UNIVERSITY (US) 2021-11-04 US claimed
US-20190314376-A1 FATTY ACID SYNTHASE INHIBITORS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2019-10-17 US claimed
CN-118086542-A Based on gtrABCIIIKit for detecting standard/variant salmonella pullorum by promoter-34 site polymorphism 湖北省农业科学院畜牧兽医研究所 2024-05-28 CN disclosed
CN-117821624-A Fluorescent quantitative PCR detection kit for rapidly distinguishing standard/variant strains of salmonella pullorum 湖北省农业科学院畜牧兽医研究所 2024-04-05 CN disclosed
CN-117757744-A Culture medium for enhancing T cell function and dryness and application thereof 中山大学 2024-03-26 CN disclosed
US-11679111-B2 Fatty acid synthase inhibitors DUKE UNIVERSITY (US) 2023-06-20 US disclosed
US-20220400732-A1 ANTI-FRUCTOSE THERAPY FOR COLORECTAL AND SMALL INTESTINE CANCERS CORNELL UNIVERSITY 2022-12-22 US disclosed
US-20210338676-A1 FATTY ACID SYNTHASE INHIBITORS DUKE UNIVERSITY (US) 2021-11-04 US disclosed
US-10966981-B2 Fatty acid synthase inhibitors DUKE UNIVERSITY (US) 2021-04-06 US disclosed
US-20190314376-A1 FATTY ACID SYNTHASE INHIBITORS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2019-10-17 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-20220400732-A1 ANTI-FRUCTOSE THERAPY FOR COLORECTAL AND SMALL INTESTINE CANCERS KHK, GCK, FN3K MEN1 2992/4885HTT 1313/4885SMN1; SMN2 4738/4885

“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.