SCHEMBL20239253

SCHEMBL20239253

CS(=O)(=O)NCCc1ccc(Oc2cc(C#N)nc(Cl)n2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.43
RAB9A P51151 1/20 0.43
KDM4E B2RXH2 1/20 0.40
CA1 P00915 3/20 0.40
CA2 P00918 3/20 0.40
CA12 O43570 2/20 0.40
CA9 Q16790 2/20 0.40
CA14 Q9ULX7 2/20 0.40
CA5A P35218 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
MAPT P10636 1/20 0.36
PLAAT3 P53816 1/20 0.36
PLAAT5 Q96KN8 1/20 0.36
PLAAT2 Q9NWW9 1/20 0.36
PLAAT4 Q9UL19 1/20 0.36
MTNR1A P48039 1/20 0.35
OPRM1 P35372 1/20 0.35
CA7 P43166 1/20 0.35
CA13 Q8N1Q1 1/20 0.35
POLB P06746 2/20 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
SCHEMBL20239233 0.87 ALDH1A1 (0.53) ALDH1A1RAB9ACA1CA2CA12
SCHEMBL20239293 0.82 SMN1; SMN2 (0.52) ALDH1A1KDM4ESMN1; SMN2MAPTPLAAT3
SCHEMBL20239137 0.82 SMN1; SMN2 (0.46) ALDH1A1CA1CA2CA12CA9
SCHEMBL20239136 0.80 CA12 (0.41) ALDH1A1KDM4ECA1CA2CA12
SCHEMBL18249758 0.78 DGAT2 (0.41) ALDH1A1RAB9AKDM4ECA1CA2
SCHEMBL20259163 0.75 ALDH1A1 (0.46) ALDH1A1RAB9ACA1CA2CA12
SCHEMBL21924535 0.73 ALDH1A1 (0.43) ALDH1A1RAB9ACA1CA2CA12
SCHEMBL20239138 0.70 EPHX2 (0.43) ALDH1A1SMN1; SMN2MAPTPLAAT3PLAAT5
SCHEMBL2093102 0.70 CA12 (0.73) ALDH1A1CA1CA2CA12CA9
SCHEMBL20239189 0.70 RAB9A (0.46) ALDH1A1RAB9ASMN1; SMN2MAPTPLAAT3

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3298001-B1 DGAT2 INHIBITORS LILLY CO ELI (US) 2020-05-13 EP disclosed
US-10053429-B2 DGAT2 inhibitors ELI LILLY AND COMPANY (US) 2018-08-21 US disclosed
US-20180162825-A1 NOVEL DGAT2 INHIBITORS ELI LILY AND COMPANY (US) 2018-06-14 US disclosed
US-20180162825-A1 NOVEL DGAT2 INHIBITORS ELI LILY AND COMPANY (US) 2018-06-14 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 (2 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-20180162825-A1 NOVEL DGAT2 INHIBITORS DGAT2, DGAT1, LCAT ALDH1A1 1430/4885RAB9A 1170/4885KDM4E 4070/4885
US-10053429-B2 DGAT2 inhibitors DGAT2, DGAT1, LCAT ALDH1A1 1189/4885RAB9A 1119/4885KDM4E 3891/4885

“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.