SCHEMBL9999441

SCHEMBL9999441

CCc1cc(Cl)c(C(=O)C(C)SC#N)cc1C

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.34
HPGD P15428 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
MAPT P10636 3/20 0.32
ALDH1A1 P00352 2/20 0.32
HTT P42858 1/20 0.32
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30
KMT2A Q03164 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
SCHEMBL9999183 0.81 PTGES (0.34) KMT2A
SCHEMBL115839 0.80 SMN1; SMN2 (0.35) LMNAHPGDSMN1; SMN2MAPTALDH1A1
SCHEMBL29936639 0.80 SMN1; SMN2 (0.35) LMNAHPGDSMN1; SMN2MAPTALDH1A1
SCHEMBL25871834 0.80 SMN1; SMN2 (0.35) LMNAHPGDSMN1; SMN2MAPTALDH1A1
SCHEMBL24809655 0.77 TSHR (0.32) MAPTKMT2A
SCHEMBL29813282 0.77 MEN1 (0.31) MAPTKMT2A
SCHEMBL23486175 0.76 GABRA1 (0.37) LMNAHPGDALDH1A1HTTCYP1A2
SCHEMBL23182669 0.76 TSHR (0.31) MAPTKMT2A
SCHEMBL11023399 0.65 PDE3B (0.43) LMNAHPGDSMN1; SMN2MAPTALDH1A1
SCHEMBL12763937 0.65 PGK1 (0.44) LMNAMAPTALDH1A1HTTKMT2A

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-8314249-B2 Process for the preparation of [4-(2-chloro-4-methoxy-5-methylphenyl)-5-methyl-thiazolo-2-yl]-[2-cyclopropyl-1-(3-fluoro-4-methylphenyl SANOFI (FR) 2012-11-20 US disclosed
US-20120083608-A1 PROCESS FOR THE PREPARATION OF [4-(2-CHLORO-4- METHOXY-5-METHYLPHENYL)-5-METHYL-THIAZOLO-2-YL]-[2-CYCLOPROPYL-1-(3-FLUORO-4-METHYLPHENYL)-ETHYL]-AMINE SANOFI (FR) 2012-04-05 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-20120083608-A1 PROCESS FOR THE PREPARATION OF [4-(2-CHLORO-4- METHOXY-5-METHYLPHENYL)-5-METHYL-THIAZOLO-2-YL]-[2-CYCLOPROPYL-1-(3-FLUORO-4-METHYLPHENYL)-ETHYL]-AMINE CYP4B1, CYP3A4, CYP4F2 LMNA 3275/4885HPGD 3160/4885SMN1; SMN2 1246/4885

“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.