SCHEMBL5546403

SCHEMBL5546403

CCOc1ccc(N(C(=O)c2ccc(C(F)(F)F)cc2F)c2nc3ccccc3s2)cc1.COc1ccc(N(C(=O)c2ccc(C#N)cc2)c2nc3ccccc3s2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.41
KDM4E B2RXH2 3/20 0.41
KMT2A Q03164 3/20 0.41
MAPT P10636 6/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
HPGD P15428 2/20 0.39
TSHR P16473 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
HSD17B10 Q99714 1/20 0.39
TP53 P04637 1/20 0.39
PPARG P37231 1/20 0.37
PPARD Q03181 1/20 0.37
PPARA Q07869 1/20 0.37
MEN1 O00255 2/20 0.37
GAA P10253 1/20 0.37
CACNA1B Q00975 1/20 0.37
ABL1 P00519 1/20 0.37
RIN1 Q13671 1/20 0.37
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 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
SCHEMBL5022929 0.89 PPARG (0.44) LMNAKDM4EKMT2AMAPTSMN1; SMN2
SCHEMBL5016943 0.87 KDM4E (0.49) LMNAKDM4EKMT2AMAPTSMN1; SMN2
SCHEMBL5016981 0.84 LMNA (0.47) LMNAKDM4EKMT2AMAPTSMN1; SMN2
SCHEMBL5016960 0.82 MAPT (0.51) LMNAKDM4EKMT2AMAPTSMN1; SMN2
SCHEMBL5016994 0.79 LMNA (0.49) LMNAKDM4EKMT2AMAPTSMN1; SMN2
SCHEMBL5023488 0.79 KDM4E (0.52) LMNAKDM4EKMT2AMAPTSMN1; SMN2
SCHEMBL5023100 0.73 SMN1; SMN2 (0.46) LMNAKDM4EKMT2AMAPTSMN1; SMN2
SCHEMBL5023114 0.71 SMN1; SMN2 (0.47) LMNAKDM4EKMT2AMAPTSMN1; SMN2
SCHEMBL5016973 0.71 KDM4E (0.50) LMNAKDM4EKMT2AMAPTSMN1; SMN2
SCHEMBL5016923 0.71 SMN1; SMN2 (0.57) LMNAKDM4EMAPTSMN1; SMN2HPGD

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-7297707-B2 Benzothiazolyl derivatives HOFFMANN-LA ROCHE INC. (US) 2007-11-20 US claimed
US-20040266845-A1 Benzothiazolyl derivatives HOFFMANN-LA ROCHE INC. 2004-12-30 US claimed

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-20040266845-A1 Benzothiazolyl derivatives CNR1, CNR2, GPR119 LMNA 4004/4885KDM4E 1919/4885KMT2A 2119/4885

“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.