SCHEMBL22803799

SCHEMBL22803799

Cc1nc(Nc2ccc3cc[nH]c3c2)ccc1Cl

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.48
SYK P43405 2/20 0.43
CMA1 P23946 1/20 0.42
AHR P35869 1/20 0.42
ESR1 P03372 5/20 0.42
CYP19A1 P11511 1/20 0.42
RET P07949 1/20 0.41
EGFR P00533 2/20 0.41
PYGL P06737 1/20 0.39
MAOA P21397 1/20 0.39
PIK3CD O00329 1/20 0.39
PIK3CA P42336 1/20 0.39
PIK3CB P42338 1/20 0.39
MTOR P42345 1/20 0.39
PIK3CG P48736 1/20 0.39
BRD4 O60885 1/20 0.38
BUB1 O43683 1/20 0.38
CDK1 P06493 1/20 0.38
KDR P35968 1/20 0.38
HTR6 P50406 1/20 0.36

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
SCHEMBL30302572 0.84 APP (0.49) APPSYKESR1CYP19A1RET
SCHEMBL22803665 0.84 APP (0.49) APPSYKESR1CYP19A1RET
SCHEMBL22803664 0.84 SYK (0.50) APPSYKCMA1AHRESR1
SCHEMBL30302577 0.84 SYK (0.50) APPSYKCMA1AHRESR1
SCHEMBL22803849 0.83 APP (0.48) APPSYKAHRESR1CYP19A1
SCHEMBL30302513 0.83 APP (0.48) APPSYKAHRESR1CYP19A1
SCHEMBL22803666 0.83 SYK (0.52) APPSYKCMA1AHRESR1
SCHEMBL30302545 0.82 APP (0.44) APPSYKCMA1AHRESR1
SCHEMBL22803681 0.82 APP (0.44) APPSYKCMA1AHRESR1
SCHEMBL12128995 0.82 APP (0.67) APPSYKCMA1AHRESR1

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-20230106899-A1 METHODS OF TREATING CANCER NOVARTIS PHARMA AG (CH) 2023-04-06 US disclosed
US-20230092163-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY NOVARTIS PHARMA AG (CH) 2023-03-23 US disclosed
WO-2020257621-A1 METHODS OF TREATING CANCER IFM DUE, INC. (US) 2020-12-24 WO disclosed
WO-2020252240-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY IFM DUE, INC. (US) 2020-12-17 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 (2 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-20230092163-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY STING1, CGAS, IRF3 APP 1751/4885SYK 748/4885CMA1 641/4885
US-20230106899-A1 METHODS OF TREATING CANCER STING1, CGAS, TBK1 APP 3042/4885SYK 1069/4885CMA1 778/4885

“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.