SCHEMBL21990112

SCHEMBL21990112

CC1(C)C(=O)N(Cc2cc(F)cc(F)c2)c2cc(C(=O)NCc3ccc(F)o3)ccc21

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
STING1 Q86WV6 2/20 0.57
CPT1A P50416 2/20 0.39
CPT1B Q92523 2/20 0.39
CPT2 P23786 1/20 0.39
MAPT P10636 2/20 0.38
HTR7 P34969 1/20 0.37
POLB P06746 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HTT P42858 1/20 0.36
DRD2 P14416 2/20 0.35
TP53 P04637 1/20 0.35
KLKB1 P03952 1/20 0.35

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
SCHEMBL21990102 0.92 STING1 (0.56) STING1CPT1ACPT1BCPT2MAPT
SCHEMBL21990054 0.85 STING1 (0.53) STING1CPT1ACPT1BCPT2MAPT
SCHEMBL21989984 0.84 STING1 (0.78) STING1CPT1ACPT1BCPT2MAPT
SCHEMBL21990069 0.84 STING1 (0.54) STING1CPT1ACPT1BCPT2HTR7
SCHEMBL21990157 0.84 STING1 (0.54) STING1CPT1ACPT1BCPT2MAPT
SCHEMBL22044816 0.83 STING1 (0.59) STING1CPT1ACPT1BCPT2MAPT
SCHEMBL21990111 0.83 STING1 (0.55) STING1CPT1ACPT1BCPT2HTR7
SCHEMBL21990117 0.82 STING1 (0.60) STING1MAPTPOLBTP53
SCHEMBL22044406 0.80 STING1 (0.58) STING1CPT1ACPT1BCPT2MAPT
SCHEMBL22043971 0.79 STING1 (0.53) STING1CPT1ACPT1BCPT2HTR7

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200172483-A1 HETEROCYCLIC SMALL MOLECULE MODULATORS OF HUMAN STING CURADEV PHARMA LIMITED (GB) 2020-06-04 US claimed
US-20200172483-A1 HETEROCYCLIC SMALL MOLECULE MODULATORS OF HUMAN STING CURADEV PHARMA LIMITED (GB) 2020-06-04 US disclosed
US-20200172483-A1 HETEROCYCLIC SMALL MOLECULE MODULATORS OF HUMAN STING CURADEV PHARMA LIMITED (GB) 2020-06-04 US 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-20200172483-A1 HETEROCYCLIC SMALL MOLECULE MODULATORS OF HUMAN STING STING1, IRF3, CGAS STING1 1/4885CPT1A 3576/4885CPT1B 4351/4885

“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.