SCHEMBL20139995

SCHEMBL20139995

COc1ccc(Br)cc1Cc1ccc2c(c1)CC2=O

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.45
TDP1 Q9NUW8 1/20 0.45
KMT2A Q03164 4/20 0.42
ALDH1A1 P00352 3/20 0.42
HSD17B1 P14061 1/20 0.41
PDE10A Q9Y233 1/20 0.40
ACHE P22303 1/20 0.40
MEN1 O00255 3/20 0.39
TP53 P04637 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
MAPT P10636 2/20 0.38
LMNA P02545 1/20 0.38
GAA P10253 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL20140009 0.92 KDM4E (0.45) KDM4ETDP1KMT2AALDH1A1ACHE
SCHEMBL20140145 0.86 PDE10A (0.41) KDM4EALDH1A1HSD17B1PDE10AACHE
SCHEMBL20139413 0.83 METAP1 (0.38) TP53MAPT
SCHEMBL20140286 0.83 METAP1 (0.38) KDM4EALDH1A1HSD17B1SMN1; SMN2LMNA
SCHEMBL20139469 0.82 SLC5A1 (0.51) KDM4ETDP1KMT2AALDH1A1MEN1
SCHEMBL20139641 0.81 SLC5A1 (0.40) KDM4EALDH1A1HSD17B1PDE10AACHE
SCHEMBL20140005 0.80 METAP1 (0.38)
SCHEMBL20140092 0.80 SLC5A2 (0.41) HSD17B1PDE10AACHE
SCHEMBL20140087 0.78 MAPK1 (0.39) KDM4EALDH1A1PDE10AACHE
SCHEMBL20139674 0.75 IL4I1 (0.36) KDM4ETDP1ALDH1A1ACHESMN1; SMN2

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 KDM4E 2780/4885TDP1 4340/4885KMT2A 1219/4885

“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.