SCHEMBL2800950

SCHEMBL2800950

CCS(=O)(=O)NC(=O)c1cnn2c(Nc3ccccc3C)c(C(=O)N3CCC4(CCc5ccccc54)CC3)cnc12

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RBP4 P02753 1/20 0.39
HPGDS O60760 1/20 0.37
OPRL1 P41146 5/20 0.36
KRAS P01116 1/20 0.36
HSD11B1 P28845 1/20 0.34
PDE4B Q07343 1/20 0.33
OPRK1 P41145 2/20 0.33
POLB P06746 1/20 0.33
SIGMAR1 Q99720 2/20 0.33
SCD O00767 1/20 0.32
HPGD P15428 1/20 0.32
ADRA1A P35348 1/20 0.32
MCHR1 Q99705 1/20 0.32

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
SCHEMBL2801254 0.90 ADRA1A (0.36) RBP4HPGDSOPRL1KRASSIGMAR1
SCHEMBL2801267 0.88 RBP4 (0.51) RBP4HPGDSOPRL1KRASHSD11B1
SCHEMBL2802960 0.88 IDO1 (0.39) PDE4BPOLBSCDHPGD
SCHEMBL2801096 0.87 KDM4E (0.41) RBP4HPGDSOPRL1HPGD
SCHEMBL2801755 0.85 PDE4B (0.37) PDE4BPOLBHPGD
SCHEMBL2801139 0.85 MCHR2 (0.40) HSD11B1
SCHEMBL2801140 0.83 ALDH1A1 (0.35) RBP4HPGDSKRASHSD11B1HPGD
SCHEMBL2798475 0.83 PRSS1 (0.37) HPGD
SCHEMBL2800768 0.82 IDO1 (0.37) PDE4BSCDHPGD
SCHEMBL2803802 0.82 AVPR1A (0.37) PDE4BPOLBSCDHPGD

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 92/4885HPGDS 1570/4885OPRL1 4872/4885

“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.