SCHEMBL20140284

SCHEMBL20140284

Cc1cc(OC(F)(F)F)c(Br)cc1C=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 1/20 0.40
LMNA P02545 2/20 0.37
GRIA1 P42261 1/20 0.35
GRIA2 P42262 1/20 0.35
GRIA3 P42263 1/20 0.35
GRIA4 P48058 1/20 0.35
CGAS Q8N884 1/20 0.34
ALDH1A1 P00352 3/20 0.33
ERN1 O75460 3/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
KDM4E B2RXH2 1/20 0.32
TSHR P16473 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CYP1A1 P04798 1/20 0.32
CYP1B1 Q16678 1/20 0.32
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MAOA P21397 1/20 0.31
MAOB P27338 1/20 0.31

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
SCHEMBL20141304 0.82 LMNA (0.42) PRKDCLMNACGASALDH1A1ERN1
SCHEMBL20140184 0.82 ALDH1A1 (0.55) PRKDCLMNAALDH1A1ERN1SMN1; SMN2
SCHEMBL21822661 0.80 ERN1 (0.41) PRKDCLMNACGASERN1CYP1A1
SCHEMBL30634680 0.80 ERN1 (0.41) PRKDCLMNACGASERN1CYP1A1
SCHEMBL2859718 0.79 PRKDC (0.58) PRKDCLMNAALDH1A1ERN1SMN1; SMN2
SCHEMBL21822689 0.79 PRKDC (0.59) PRKDCLMNACGASALDH1A1ERN1
SCHEMBL21822743 0.77 CGAS (0.45) PRKDCLMNACGASERN1CYP1A1
SCHEMBL21822957 0.76 LMNA (0.38) PRKDCLMNACGASALDH1A1ERN1
SCHEMBL22230887 0.75 PRKDC (0.59) PRKDCLMNACGASALDH1A1ERN1
SCHEMBL30860858 0.75 POLB (0.39) CGASALDH1A1TSHRTDP1L3MBTL1

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 PRKDC 4220/4885LMNA 2950/4885GRIA1 804/4885

“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.