SCHEMBL30288271

SCHEMBL30288271

CC(C)(C)C(C)(C)CNc1cc(Cl)cc(Cl)c1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
HPGD P15428 1/20 0.37
CYP2C19 P33261 1/20 0.37
RAPGEF4 Q8WZA2 1/20 0.34
GAA P10253 2/20 0.33
TSHR P16473 1/20 0.33
FDPS P14324 1/20 0.32
DEPTOR Q8TB45 1/20 0.31
LMNA P02545 2/20 0.31
MAPT P10636 2/20 0.31
IDO1 P14902 2/20 0.31
ALOX12 P18054 1/20 0.31
IDH1 O75874 1/20 0.30
ACP1 P24666 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
SCHEMBL30288240 0.84 ALDH1A1 (0.39) ALDH1A1L3MBTL1CYP1A2CYP2C9HPGD
SCHEMBL12932880 0.83 ALDH1A1 (0.39) ALDH1A1L3MBTL1CYP1A2CYP2C9HPGD
SCHEMBL30288237 0.81 GRM5 (0.42) ALDH1A1GAALMNAMAPTIDH1
SCHEMBL30288264 0.77 THRB (0.42) ALDH1A1L3MBTL1CYP1A2CYP2C9HPGD
SCHEMBL30288243 0.71 ALDH1A1 (0.41) ALDH1A1L3MBTL1CYP1A2CYP2C9HPGD
SCHEMBL8247975 0.70 FDPS (0.47) ALDH1A1L3MBTL1RAPGEF4GAATSHR
SCHEMBL3398764 0.70 ALDH1A1 (0.42) ALDH1A1L3MBTL1CYP1A2CYP2C9HPGD
SCHEMBL30288278 0.70 ALDH1A1 (0.44) ALDH1A1L3MBTL1CYP1A2CYP2C9CYP2C19
SCHEMBL11526524 0.69 ALDH1A1 (0.50) ALDH1A1L3MBTL1CYP1A2CYP2C9HPGD
SCHEMBL11653603 0.69 TSHR (0.47) ALDH1A1L3MBTL1CYP1A2CYP2C9HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230055237-A1 COMPOUNDS AND METHODS FOR THE TREATMENT OF CYSTIC FIBROSIS FLATLEY DISCOVERY LAB, LLC 2023-02-23 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-20230055237-A1 COMPOUNDS AND METHODS FOR THE TREATMENT OF CYSTIC FIBROSIS CFTR, MPST, CRAT ALDH1A1 215/4885L3MBTL1 4267/4885CYP1A2 634/4885

“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.