SCHEMBL2801068

SCHEMBL2801068

O=C(NS(=O)(=O)c1ccccc1)c1cnn2c(NCc3ccccc3)c(C(=O)N3CCC(c4ccccc4)CC3)cnc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RBP4 P02753 1/20 0.39
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
CA14 Q9ULX7 1/20 0.38
THRB P10828 1/20 0.37
STAT6 P42226 1/20 0.37
ENPP2 Q13822 1/20 0.37
SPR P35270 2/20 0.37
TPSAB1 Q15661 1/20 0.37
HPGD P15428 2/20 0.36
LMNA P02545 2/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
OPRM1 P35372 1/20 0.36
OPRK1 P41145 1/20 0.36
ALDH1A1 P00352 3/20 0.36
TSHR P16473 1/20 0.36

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
SCHEMBL2799687 0.92 STAT6 (0.40) RBP4CA12CA1CA2CA7
SCHEMBL2805767 0.90 RBP4 (0.37) RBP4CA12CA1CA2CA7
SCHEMBL2799699 0.90 SPR (0.38) CA12CA1CA2CA7CA9
SCHEMBL2804072 0.90 STAT6 (0.41) CA12CA1CA2CA7CA9
SCHEMBL2802824 0.90 STAT6 (0.39) CA12CA1CA2CA7CA9
SCHEMBL2803145 0.90 STAT6 (0.38) CA12CA1CA2CA7CA9
SCHEMBL2800008 0.89 TPSAB1 (0.38) THRBSTAT6ENPP2SPRTPSAB1
SCHEMBL2800936 0.88 STAT6 (0.42) THRBSTAT6ENPP2SPRALDH1A1
SCHEMBL2802391 0.87 SMN1; SMN2 (0.41) THRBSTAT6ENPP2SPRHPGD
SCHEMBL2801524 0.87 ALDH1A1 (0.37) THRBSTAT6ENPP2HPGDSMN1; SMN2

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-2206714-B1 AGENT FOR PREVENTION AND/OR TREATMENT OF SKIN DISEASES KYOWA HAKKO KIRIN CO LTD (JP) 2015-01-21 EP disclosed
US-8729264-B2 Agent for prevention and/or treatment of skin diseases KYOWA HAKKO KIRIN CO., LTD. (JP) 2014-05-20 US disclosed
US-20100256134-A1 AGENT FOR PREVENTION AND/OR TREATMENT OF SKIN DISEASES KYOWA HAKKO KIRIN CO., LTD. (JP) 2010-10-07 US disclosed
EP-2206714-A1 AGENT FOR PREVENTION AND/OR TREATMENT OF SKIN DISEASES Kyowa Hakko Kirin Co., Ltd. (JP) 2010-07-14 EP 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-20100256134-A1 AGENT FOR PREVENTION AND/OR TREATMENT OF SKIN DISEASES TYR, CUTA, SERPINB1 RBP4 92/4885CA12 2287/4885CA1 4641/4885

“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.