SCHEMBL31257136

SCHEMBL31257136

C=C(c1cn(C(=O)OC(C)(C)C)cn1)c1cccc(C)c1C

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.34
MAPT P10636 4/20 0.32
LMNA P02545 2/20 0.32
TP53 P04637 1/20 0.32
ALDH1A1 P00352 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.31
KDM4E B2RXH2 1/20 0.31
HTT P42858 1/20 0.31
CCNK O75909 1/20 0.31
CCNA2 P20248 1/20 0.31
CDK2 P24941 1/20 0.31
CCND3 P30281 1/20 0.31
CDK9 P50750 1/20 0.31
CDK6 Q00534 1/20 0.31
BTK Q06187 1/20 0.31
GPR119 Q8TDV5 1/20 0.31
ADRB2 P07550 1/20 0.31
ADRB1 P08588 1/20 0.31
ADRB3 P13945 1/20 0.31
GRM5 P41594 1/20 0.31

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
SCHEMBL29162726 0.77 ESR1 (0.34) LMNATP53ALDH1A1SMN1; SMN2KDM4E
SCHEMBL31257135 0.73 DGAT2 (0.36) POLBMAPTLMNATP53ALDH1A1
SCHEMBL7101531 0.73 MAPT (0.46) MAPTLMNATP53ALDH1A1SMN1; SMN2
SCHEMBL2471937 0.72 GPR119 (0.37) POLBKDM4EHTTGPR119MEN1
SCHEMBL5849847 0.72 GPR119 (0.37) POLBMAPTHTTGPR119MEN1
SCHEMBL31326699 0.71 GPR119 (0.36) POLBMAPTLMNASMN1; SMN2HTT
SCHEMBL30437740 0.70 MEN1 (0.42) LMNAALDH1A1GPR119MEN1KMT2A
SCHEMBL31072363 0.70 CYP11B1 (0.33) LMNASMN1; SMN2KDM4EHTTMEN1
SCHEMBL5172212 0.69 GPR119 (0.38) POLBMAPTSMN1; SMN2HTTGPR119
SCHEMBL6172899 0.68 GPR119 (0.38) POLBMAPTSMN1; SMN2HTTGPR119

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-20240391878-A1 METHOD FOR PREPARING TERT-BUTYL (S)-4-(1-(2,3-DIMETHYLPHENYL)ETHYL)-1H-IMIDAZOLE-1-CARBOXYLATE AND SALTS THEREOF AND ITS USE IN A METHOD FOR PREPARING (S)-4-(1-(2,3-DIMETHYLPHENYL)ETHYL)-1H-IMIDAZOLE AND SALTS THEREOF MOEHS IBERICA, S.L. (ES) 2024-11-28 US claimed
EP-4467534-A1 METHOD FOR PREPARING TERT-BUTYL (S)-4-(1-(2,3-DIMETHYLPHENYL)ETHYL)-1H-IMIDAZOLE-1-CARBOXYLATE AND SALTS THEREOF AND ITS USE IN A METHOD FOR PREPARING (S)-4-(1-(2,3-DIMETHYLPHENYL)ETHYL)-1H-IMIDAZOLE AND SALTS THEREOF Moehs Ibérica, S.L. (ES) 2024-11-27 EP claimed
US-20240391878-A1 METHOD FOR PREPARING TERT-BUTYL (S)-4-(1-(2,3-DIMETHYLPHENYL)ETHYL)-1H-IMIDAZOLE-1-CARBOXYLATE AND SALTS THEREOF AND ITS USE IN A METHOD FOR PREPARING (S)-4-(1-(2,3-DIMETHYLPHENYL)ETHYL)-1H-IMIDAZOLE AND SALTS THEREOF MOEHS IBERICA, S.L. (ES) 2024-11-28 US disclosed
EP-4467534-A1 METHOD FOR PREPARING TERT-BUTYL (S)-4-(1-(2,3-DIMETHYLPHENYL)ETHYL)-1H-IMIDAZOLE-1-CARBOXYLATE AND SALTS THEREOF AND ITS USE IN A METHOD FOR PREPARING (S)-4-(1-(2,3-DIMETHYLPHENYL)ETHYL)-1H-IMIDAZOLE AND SALTS THEREOF Moehs Ibérica, S.L. (ES) 2024-11-27 EP 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-20240391878-A1 METHOD FOR PREPARING TERT-BUTYL (S)-4-(1-(2,3-DIMETHYLPHENYL)ETHYL)-1H-IMIDAZOLE-1-CARBOXYLATE AND SALTS THEREOF AND ITS USE IN A METHOD FOR PREPARING (S)-4-(1-(2,3-DIMETHYLPHENYL)ETHYL)-1H-IMIDAZOLE AND SALTS THEREOF ADRA1A, AVPR1A, THRA POLB 656/4885MAPT 2541/4885LMNA 1966/4885

“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.