SCHEMBL19252821

SCHEMBL19252821

CCOc1ccc(C=O)c(-c2cc(I)ccc2Cl)c1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 2/20 0.45
FFAR1 O14842 1/20 0.45
ERN1 O75460 4/20 0.45
KMT2A Q03164 1/20 0.38
PDE2A O00408 3/20 0.37
TAS1R3 Q7RTX0 1/20 0.36
TAS1R1 Q7RTX1 1/20 0.36
ALDH1A1 P00352 3/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
MAPT P10636 2/20 0.35
GAA P10253 1/20 0.35
HPGD P15428 1/20 0.34
CSNK1D P48730 1/20 0.34

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
SCHEMBL30640 0.84 FFAR1 (0.45) FFAR4FFAR1ERN1KMT2APDE2A
SCHEMBL6319246 0.77 ERN1 (0.54) ERN1KMT2AALDH1A1MAPTGAA
SCHEMBL28897598 0.76 FFAR4 (0.56) FFAR4FFAR1KMT2ATAS1R3TAS1R1
SCHEMBL4966501 0.75 ERN1 (0.39) ERN1ALDH1A1
SCHEMBL28014664 0.74 NQO1 (0.45) ERN1KMT2AALDH1A1MAPTGAA
SCHEMBL2505577 0.72 HDAC8 (0.50) FFAR4FFAR1ERN1ALDH1A1L3MBTL1
SCHEMBL30453 0.69 LMNA (0.40) ERN1KMT2APDE2AALDH1A1L3MBTL1
SCHEMBL1125718 0.69 ALDH1A1 (0.55) ERN1ALDH1A1L3MBTL1MAPTGAA
SCHEMBL3721962 0.69 ALDH1A1 (0.47) ERN1KMT2AALDH1A1MAPTGAA
SCHEMBL9498221 0.69 NQO1 (0.46) ERN1KMT2AALDH1A1MAPTGAA

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-9834533-B2 Process for preparing SGLT2 inhibitors and intermediates thereof SCINOPHARM TAIWAN, LTD. (TW) 2017-12-05 US disclosed
US-20170240520-A1 PROCESS FOR PREPARING SGLT2 INHIBITORS AND INTERMEDIATES THEREOF SCINOPHARM TAIWAN, LTD. (TW) 2017-08-24 US 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-20170240520-A1 PROCESS FOR PREPARING SGLT2 INHIBITORS AND INTERMEDIATES THEREOF SLC5A2, SLC5A1, DPP4 FFAR4 512/4885FFAR1 1388/4885ERN1 2012/4885

“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.