SCHEMBL5027182

SCHEMBL5027182

COc1ccc(N(C(=O)c2ccc(Cl)cc2Cl)c2nc3c(NS(C)(=O)=O)cc(-c4ccccc4)cc3s2)cc1OC

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ACLY P53396 14/20 0.39
CCR2 P41597 1/20 0.37
FLT1 P17948 1/20 0.37
FLT4 P35916 1/20 0.37
KDR P35968 1/20 0.37
KDM4E B2RXH2 1/20 0.37
GAA P10253 1/20 0.37
HPGD P15428 1/20 0.37
ACACB O00763 1/20 0.37
ACACA Q13085 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
CRHBP P24387 1/20 0.36
CRHR2 Q13324 1/20 0.36
ALDH1A1 P00352 1/20 0.35
MAPK1 P28482 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
SCHEMBL5023522 0.93 ALDH1A1 (0.39) ACLYCCR2KDM4EACACBACACA
SCHEMBL5027363 0.89 KDM4E (0.39) ACLYFLT1FLT4KDRKDM4E
Benzene SCHEMBL5023466 0.89 FLT1 (0.39) CCR2FLT1FLT4KDRKDM4E
Benzene SCHEMBL5016963 0.83 KMT2A (0.42) CCR2KDM4EHPGDMEN1KMT2A
SCHEMBL5022975 0.83 MEN1 (0.41) CCR2FLT1FLT4KDRKDM4E
Benzene SCHEMBL5016998 0.80 DYRK1A (0.39) FLT1FLT4KDRKDM4EGAA
SCHEMBL5022960 0.80 KDM4E (0.42) FLT1FLT4KDRKDM4EGAA
SCHEMBL5023546 0.78 KDM4E (0.51) KDM4EGAAHPGDMEN1KMT2A
SCHEMBL5027178 0.77 KDM4E (0.40) FLT1FLT4KDRKDM4EGAA
SCHEMBL5022970 0.77 GPR27 (0.44) FLT1FLT4KDRKDM4EGAA

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
EP-1638556-B1 2-AMINOBENZOTHIAZOLES AS CB1 RECEPTOR INVERSE AGONISTS HOFFMANN LA ROCHE (CH) 2008-04-02 EP claimed
US-20070021478-A1 Benzothiazolyl derivatives NETTEKOVEN MATTHIAS H 2007-01-25 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-20070021478-A1 Benzothiazolyl derivatives CNR1, CNR2, GPR119 ACLY 1522/4885CCR2 221/4885FLT1 1589/4885

“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.