SCHEMBL23830301

SCHEMBL23830301

CSc1ncnc(CO)c1C

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.42
LMNA P02545 2/20 0.42
TP53 P04637 2/20 0.36
HSD17B10 Q99714 1/20 0.36
KDM4E B2RXH2 1/20 0.35
CYP1A2 P05177 1/20 0.33
TSHR P16473 1/20 0.33
NOTUM Q6P988 5/20 0.32
HPGD P15428 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
CSNK2A2 P19784 1/20 0.31
CSNK2B P67870 1/20 0.31
CSNK2A1 P68400 1/20 0.31

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
SCHEMBL23830337 0.79 ALDH1A1 (0.42) ALDH1A1LMNATP53HSD17B10CYP1A2
SCHEMBL21246623 0.75 LMNA (0.48) ALDH1A1LMNATP53HSD17B10CYP1A2
SCHEMBL1663033 0.72 KDM4E (0.32) ALDH1A1HSD17B10KDM4EHPGD
SCHEMBL1660929 0.72 ALDH1A1 (0.34) ALDH1A1LMNAKDM4ENOTUMSMN1; SMN2
SCHEMBL23830360 0.71 HSD17B10 (0.45) ALDH1A1LMNAHSD17B10KDM4ECYP1A2
SCHEMBL10566960 0.69 MAPK1 (0.36) ALDH1A1LMNATP53HSD17B10KDM4E
SCHEMBL23830411 0.68 HSD17B10 (0.43) ALDH1A1LMNATP53HSD17B10KDM4E
SCHEMBL3392319 0.68 HSP90AA1 (0.42) ALDH1A1KDM4E
SCHEMBL3951225 0.67 TP53 (0.36) ALDH1A1LMNATP53HSD17B10CYP1A2
SCHEMBL24924192 0.67 TP53 (0.36) ALDH1A1LMNATP53HSD17B10CYP1A2

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-20210292333-A1 CONDENSED AZAHETEROARYL COMPOUNDS HAVING ANTIBACTERIAL ACTIVITY AGAINST TUBERCULOSIS BACTERIA CADILA HEALTHCARE LIMITED (IN) 2021-09-23 US disclosed
CN-112543757-A Condensed azaheteroaryl compounds having antibacterial activity against tubercle bacillus 卡迪拉保健有限公司 2021-03-23 CN 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-20210292333-A1 CONDENSED AZAHETEROARYL COMPOUNDS HAVING ANTIBACTERIAL ACTIVITY AGAINST TUBERCULOSIS BACTERIA DPEP1, SAT1, PEPD ALDH1A1 152/4885LMNA 2123/4885TP53 3652/4885

“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.