SCHEMBL20132264

SCHEMBL20132264

Cc1ccc(Sc2ccc(Cl)c(N)c2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.43
TP53 P04637 2/20 0.43
MAPK1 P28482 4/20 0.42
ALDH1A1 P00352 4/20 0.42
ALOX15 P16050 4/20 0.42
HSD17B10 Q99714 3/20 0.42
MAPT P10636 3/20 0.42
HPGD P15428 3/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
GAA P10253 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
CA14 Q9ULX7 1/20 0.41
BCL2 P10415 1/20 0.40
MCL1 Q07820 1/20 0.40
PDE7A Q13946 2/20 0.39

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
SCHEMBL3791588 0.82 TSHR (0.45) TSHRTP53MAPK1ALDH1A1HPGD
SCHEMBL11630774 0.82 TDP1 (0.56) TSHRTP53MAPK1ALDH1A1ALOX15
SCHEMBL21301917 0.80 ALDH1A1 (0.58) TSHRTP53MAPK1ALDH1A1ALOX15
SCHEMBL15955705 0.78 RHEB (0.41) TSHRMAPK1ALDH1A1ALOX15HSD17B10
SCHEMBL6009396 0.78 ALDH1A1 (0.63) TSHRTP53MAPK1ALDH1A1ALOX15
SCHEMBL20132348 0.78 RAB9A (0.47) MAPK1ALDH1A1MAPTHPGDGAA
Hydrochloric Acid SCHEMBL7713239 0.77 ALDH1A1 (0.61) TSHRTP53MAPK1ALDH1A1ALOX15
SCHEMBL753599 0.77
SCHEMBL31351887 0.77
SCHEMBL3793427 0.75 TSHR (0.50) TSHRTP53ALDH1A1HSD17B10MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3901162-A1 GLUCOCORTICOID RECEPTOR AGONIST AND IMMUNOCONJUGATES THEREOF AbbVie Inc. (US) 2021-10-27 EP disclosed
US-20200338208-A1 GLUCOCORTICOID RECEPTOR AGONIST AND IMMUNOCONJUGATES THEREOF ABBVIE INC. (US) 2020-10-29 US disclosed
US-20180126000-A1 GLUCOCORTICOID RECEPTOR AGONIST AND IMMUNOCONJUGATES THEREOF ABBVIE INC. (US) 2018-05-10 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-20180126000-A1 GLUCOCORTICOID RECEPTOR AGONIST AND IMMUNOCONJUGATES THEREOF NR3C1, NR3C2, MC2R TSHR 126/4885TP53 3339/4885MAPK1 2345/4885
US-20200338208-A1 GLUCOCORTICOID RECEPTOR AGONIST AND IMMUNOCONJUGATES THEREOF NR3C1, NR3C2, MC2R TSHR 126/4885TP53 3339/4885MAPK1 2345/4885

“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.