SCHEMBL23830363

SCHEMBL23830363

CCOC(=O)c1nn(Cc2ccc(C)nc2OC)c2cc(C)cnc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSF1R P07333 1/20 0.44
CCR4 P51679 1/20 0.40
NPC1 O15118 1/20 0.38
MAPT P10636 1/20 0.38
NLRP3 Q96P20 1/20 0.38
ELANE P08246 7/20 0.36
LMNA P02545 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
GABRA1 P14867 1/20 0.35
GABRA5 P31644 1/20 0.35
NOD2 Q9HC29 1/20 0.34
NOD1 Q9Y239 1/20 0.34
GAA P10253 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
PDE4A P27815 2/20 0.34
PDE4B Q07343 2/20 0.34
PDE4C Q08493 2/20 0.34
PDE4D Q08499 2/20 0.34
PDE6D O43924 1/20 0.33
PDE6A P16499 1/20 0.33

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
SCHEMBL23830323 0.89 CSF1R (0.44) CSF1RGAAPDE6DPDE6APDE6G
SCHEMBL23830378 0.80 CSF1R (0.41) CSF1RPDE6DPDE6APDE6GPDE6B
SCHEMBL23830385 0.79 PDE6D (0.52) ELANELMNASMN1; SMN2PDE4APDE4B
SCHEMBL23830352 0.74 PDE6D (0.44) CCR4NPC1ELANELMNASMN1; SMN2
SCHEMBL23830317 0.73 PDE6D (0.37) CCR4NPC1MAPTELANELMNA
SCHEMBL12788013 0.73 CYP1A2 (0.49) CCR4NPC1LMNASMN1; SMN2
SCHEMBL23830376 0.72 PDE6D (0.45) ELANELMNASMN1; SMN2GABRA1GABRA5
SCHEMBL23830349 0.72 PDE6D (0.38) CCR4NPC1MAPTELANELMNA
SCHEMBL23830296 0.71 PDE6D (0.37) CCR4NPC1ELANELMNASMN1; SMN2
SCHEMBL23830357 0.69 PDE6D (0.40) CCR4ELANEPDE4APDE4BPDE4C

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 CSF1R 532/4885CCR4 2565/4885NPC1 983/4885

“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.