SCHEMBL23830406

SCHEMBL23830406

COCCOc1ncnc(CO)c1C

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.40
HSD17B10 Q99714 1/20 0.35
HTT P42858 2/20 0.35
KDM4E B2RXH2 1/20 0.35
PDE6D O43924 3/20 0.33
PDE6A P16499 3/20 0.33
PDE6G P18545 3/20 0.33
PDE6B P35913 3/20 0.33
PDE6C P51160 3/20 0.33
PDE6H Q13956 3/20 0.33
KDM1A O60341 3/20 0.33
FFAR2 O15552 1/20 0.33
PTGS2 P35354 1/20 0.30

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
SCHEMBL23830424 0.84 TSHR (0.39) TSHRKDM1AFFAR2
SCHEMBL23830411 0.81 HSD17B10 (0.43) HSD17B10KDM4EPDE6DPDE6APDE6G
SCHEMBL23830360 0.81 HSD17B10 (0.45) TSHRHSD17B10KDM4EPDE6DPDE6A
SCHEMBL25467307 0.79 TSHR (0.47) TSHRKDM1AFFAR2
SCHEMBL23830402 0.75 ACACB (0.45) HSD17B10PDE6DPDE6APDE6GPDE6B
SCHEMBL16395481 0.74 HSD17B10 (0.35) HSD17B10PDE6DPDE6APDE6GPDE6B
SCHEMBL23830372 0.71 HSD17B10 (0.45) TSHRHSD17B10HTTKDM4E
SCHEMBL22143386 0.69 TSHR (0.41) TSHRKDM1AFFAR2
SCHEMBL25517393 0.68 TSHR (0.44) TSHRHTTKDM1AFFAR2
SCHEMBL12236490 0.67 CHRM1 (0.39)

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 TSHR 2466/4885HSD17B10 1210/4885HTT 4848/4885

“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.