SCHEMBL20140036

SCHEMBL20140036

Brc1cccc(Cc2ccc3c(c2)CC3)c1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 3/20 0.44
PARP1 P09874 1/20 0.44
IDO1 P14902 2/20 0.43
AGXT P21549 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
MAOB P27338 3/20 0.42
MAOA P21397 2/20 0.42
PYCR1 P32322 1/20 0.39
SIGMAR1 Q99720 1/20 0.38
HCAR2 Q8TDS4 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
SCHEMBL9200966 0.82 TAAR1 (0.60) TAAR1IDO1AGXTSMN1; SMN2TDP1
SCHEMBL9351968 0.78 TAAR1 (0.52) TAAR1PARP1IDO1AGXTSMN1; SMN2
SCHEMBL31499406 0.76 CALM1 (0.57) TAAR1IDO1AGXTSMN1; SMN2TDP1
SCHEMBL4717 0.76 CALM1 (0.57) TAAR1IDO1AGXTSMN1; SMN2TDP1
SCHEMBL5675962 0.75 PARP11 (0.50)
SCHEMBL3890987 0.73 TAAR1 (0.47) TAAR1PARP1IDO1AGXTSMN1; SMN2
SCHEMBL16682942 0.73 SNCA (0.47)
SCHEMBL27791814 0.73 PARP11 (0.49)
SCHEMBL754462 0.73 MAOB (0.54) TAAR1IDO1AGXTSMN1; SMN2MAOB
SCHEMBL1631126 0.73 MAOB (0.54) TAAR1IDO1AGXTSMN1; SMN2MAOB

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 TAAR1 2572/4885PARP1 3689/4885IDO1 2776/4885

“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.