SCHEMBL23830337

SCHEMBL23830337

CSc1ncnc(CBr)c1C

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.42
LMNA P02545 2/20 0.42
TP53 P04637 1/20 0.36
HSD17B10 Q99714 1/20 0.36
CYP1A2 P05177 1/20 0.33
TSHR P16473 1/20 0.33
HPGD P15428 1/20 0.32

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
SCHEMBL23830301 0.79 ALDH1A1 (0.42) ALDH1A1LMNATP53HSD17B10CYP1A2
SCHEMBL21246623 0.70 LMNA (0.48) ALDH1A1LMNATP53HSD17B10CYP1A2
SCHEMBL3393888 0.68 HSP90AA1 (0.42)
SCHEMBL24924192 0.67 TP53 (0.36) ALDH1A1LMNATP53HSD17B10CYP1A2
SCHEMBL3951225 0.67 TP53 (0.36) ALDH1A1LMNATP53HSD17B10CYP1A2
SCHEMBL8573829 0.67 TP53 (0.36) ALDH1A1LMNATP53HSD17B10CYP1A2
SCHEMBL21794553 0.64 GAA (0.33) ALDH1A1HPGD
SCHEMBL12261900 0.64 LMNA (0.43) ALDH1A1LMNATP53HSD17B10CYP1A2
SCHEMBL5064766 0.62 TP53 (0.43) ALDH1A1LMNATP53HSD17B10CYP1A2
SCHEMBL23264073 0.62 ALDH1A1 (0.38) 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.