SCHEMBL20140005

SCHEMBL20140005

O=C1Cc2cc(Cc3cc(Br)ccc3Cl)ccc21

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 1/20 0.38
TDP2 O95551 1/20 0.37
MAOA P21397 4/20 0.35
MAOB P27338 4/20 0.35
SLC5A2 P31639 3/20 0.34
SLC5A1 P13866 1/20 0.34
CCR5 P51681 1/20 0.34
PARP11 Q9NR21 1/20 0.33
CMA1 P23946 1/20 0.33
AHR P35869 1/20 0.33
S100A4 P26447 1/20 0.32

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
SCHEMBL20140006 0.92 IL4I1 (0.36) METAP1TDP2MAOAMAOBSLC5A2
SCHEMBL20139413 0.83 METAP1 (0.38) METAP1TDP2MAOAMAOBSLC5A2
SCHEMBL20140286 0.83 METAP1 (0.38) METAP1TDP2MAOAMAOBSLC5A2
SCHEMBL20139367 0.81 SLC5A2 (0.48) SLC5A2SLC5A1CCR5
SCHEMBL20139995 0.80 KDM4E (0.45)
SCHEMBL20140092 0.78 SLC5A2 (0.41) SLC5A2SLC5A1
SCHEMBL20139399 0.76 SLC5A2 (0.42) SLC5A2SLC5A1CCR5
SCHEMBL20139674 0.75 IL4I1 (0.36) METAP1TDP2MAOAMAOBSLC5A2
SCHEMBL20139694 0.75 IL4I1 (0.36) METAP1TDP2SLC5A2SLC5A1CMA1
SCHEMBL14488028 0.75 METAP1 (0.60) METAP1TDP2PARP11CMA1AHR

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-10815210-B2 Benzocyclobutane derivatives useful as dual SGLT1 / SGLT2 modulators JANSSEN PHARMACEUTICA NV (BE) 2020-10-27 US disclosed
WO-2018089449-A1 BENZOCYCLOBUTANE DERIVATIVES USEFUL AS DUAL SGLT1/SGLT2 MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2018-05-17 WO 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-10815210-B2 Benzocyclobutane derivatives useful as dual SGLT1 / SGLT2 modulators SLC5A2, SLC5A1, SLC2A2 METAP1 2835/4885TDP2 2943/4885MAOA 3829/4885

“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.