SCHEMBL20139491

SCHEMBL20139491

Cc1cc(OCc2ccccc2)c(Br)cc1Cc1ccc2c(c1)CC2

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.45
HTR2C P28335 1/20 0.45
SLC5A1 P13866 4/20 0.43
SLC5A2 P31639 4/20 0.43
HRH3 Q9Y5N1 3/20 0.41
CHRNA7 P36544 2/20 0.40
CCR5 P51681 1/20 0.38
MAPT P10636 1/20 0.38
MAPK1 P28482 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
RXRA P19793 1/20 0.38
RXRB P28702 1/20 0.38
RXRG P48443 1/20 0.38
FFAR4 Q5NUL3 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 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
SCHEMBL20139411 0.87 CHRNA7 (0.47) HTR2AHTR2CSLC5A1SLC5A2HRH3
SCHEMBL20141555 0.87 HTR2A (0.44) HTR2AHTR2CSLC5A1SLC5A2HRH3
SCHEMBL7632432 0.86 TDP1 (0.47) HTR2AHTR2CCCR5MAPTMAPK1
SCHEMBL20140091 0.86 SLC5A1 (0.42) HTR2AHTR2CSLC5A1SLC5A2HRH3
SCHEMBL20139495 0.86 HTR2A (0.42) HTR2AHTR2CSLC5A1SLC5A2HRH3
SCHEMBL20140059 0.85 HTR2A (0.43) HTR2AHTR2CHRH3CHRNA7CCR5
SCHEMBL20142219 0.84 FFAR4 (0.40) HTR2AHTR2CCCR5RXRARXRB
SCHEMBL3229125 0.84 MAPT (0.45) HTR2AHTR2CCCR5MAPTMAPK1
SCHEMBL20139432 0.83 HTR2A (0.45) HTR2AHTR2CSLC5A1SLC5A2HRH3
SCHEMBL3215337 0.83 MAPT (0.42) HTR2AHTR2CSLC5A1SLC5A2CCR5

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 HTR2A 862/4885HTR2C 879/4885SLC5A1 2/4885

“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.