SCHEMBL29030799

SCHEMBL29030799

CCOC(=O)c1sc(CC)nc1CO

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.47
CYP1A2 P05177 1/20 0.47
HSD17B10 Q99714 2/20 0.45
GAA P10253 1/20 0.45
KMT2A Q03164 1/20 0.45
HPGD P15428 2/20 0.44
LMNA P02545 1/20 0.44
KDM4E B2RXH2 2/20 0.43
CDC7 O00311 4/20 0.42
DBF4 Q9UBU7 4/20 0.42
NPC1 O15118 1/20 0.41
MAPT P10636 1/20 0.41
RAB9A P51151 1/20 0.41
MC4R P32245 1/20 0.41
TRPM8 Q7Z2W7 2/20 0.41
PTPN11 Q06124 1/20 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
SCHEMBL7620013 0.87 ALDH1A1 (0.49) ALDH1A1CYP1A2HSD17B10GAAKMT2A
SCHEMBL15581984 0.86 ALDH1A1 (0.46) ALDH1A1CYP1A2HSD17B10GAAKMT2A
SCHEMBL5553648 0.83 ALDH1A1 (0.58) ALDH1A1CYP1A2HSD17B10KMT2AHPGD
SCHEMBL1921091 0.81 ALDH1A1 (0.49) ALDH1A1CYP1A2HSD17B10GAAKMT2A
SCHEMBL9795347 0.81 TRPM8 (0.56) ALDH1A1CYP1A2KMT2AHPGDLMNA
SCHEMBL1553106 0.80 ALDH1A1 (0.47) ALDH1A1CYP1A2HSD17B10GAAKMT2A
SCHEMBL1552396 0.80 ALDH1A1 (0.69) ALDH1A1CYP1A2HSD17B10GAAKMT2A
SCHEMBL5552772 0.80 ALDH1A1 (0.41) ALDH1A1CYP1A2HSD17B10GAAKMT2A
SCHEMBL29030788 0.80 ALDH1A1 (0.43) ALDH1A1CYP1A2HSD17B10GAAKMT2A
SCHEMBL29030796 0.78 ALDH1A1 (0.46) ALDH1A1CYP1A2HSD17B10GAAKMT2A

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
US-20240043450-A1 NEW COMPOUND JANSSEN PHARMACEUTICA NV (BE) 2024-02-08 US disclosed
EP-4217347-A1 NEW COMPOUNDS JANSSEN Pharmaceutica NV (BE) 2023-08-02 EP disclosed
CN-116194445-A New compounds 詹森药业有限公司 2023-05-30 CN disclosed
WO-2022063896-A1 NEW COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2022-03-31 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-20240043450-A1 NEW COMPOUND NLRP3, NLRP1, PYCARD ALDH1A1 1954/4885CYP1A2 1468/4885HSD17B10 1598/4885

“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.