SCHEMBL20141304

SCHEMBL20141304

CCc1cc(OC(F)(F)F)c(Br)cc1C=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.42
PRKDC P78527 1/20 0.39
CGAS Q8N884 1/20 0.34
POLB P06746 1/20 0.33
DDR1 Q08345 1/20 0.33
ALDH1A1 P00352 3/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
HTR2A P28223 1/20 0.33
ERN1 O75460 1/20 0.32
SIGMAR1 Q99720 2/20 0.31
ALDH1A3 P47895 1/20 0.31
CYP1A1 P04798 1/20 0.31
CYP1B1 Q16678 1/20 0.31
KDM4E B2RXH2 1/20 0.31
TSHR P16473 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MAOA P21397 1/20 0.30

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
SCHEMBL20140284 0.82 PRKDC (0.40) LMNAPRKDCCGASALDH1A1L3MBTL1
SCHEMBL20140184 0.81 ALDH1A1 (0.55) LMNAPRKDCALDH1A1L3MBTL1ERN1
SCHEMBL16018637 0.80 PRKDC (0.56) LMNAPRKDCALDH1A1L3MBTL1HTR2A
SCHEMBL21822661 0.79 ERN1 (0.41) LMNAPRKDCCGASPOLBERN1
SCHEMBL31285025 0.79 HTR2A (0.47) HTR2A
SCHEMBL30634680 0.79 ERN1 (0.41) LMNAPRKDCCGASPOLBERN1
SCHEMBL21822957 0.78 LMNA (0.38) LMNAPRKDCCGASPOLBALDH1A1
SCHEMBL21822689 0.77 PRKDC (0.59) LMNAPRKDCCGASALDH1A1L3MBTL1
SCHEMBL21822743 0.75 CGAS (0.45) LMNAPRKDCCGASPOLBERN1
SCHEMBL21822662 0.75 LMNA (0.44) LMNAPRKDCCGASPOLBALDH1A1

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 LMNA 2950/4885PRKDC 4220/4885CGAS 3120/4885

“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.