SCHEMBL2801382

SCHEMBL2801382

CCS(=O)(=O)NC(=O)c1cnn2c(Nc3ccc(F)cc3C)c(C(=O)N3CCC4(CC3)OC(C)(C)c3ccccc34)cnc12

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 12/20 0.35
MAPK1 P28482 1/20 0.35
CBX7 O95931 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.32
ALDH2 P05091 1/20 0.32
ALDH1A3 P47895 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
SCHEMBL2800771 0.90 SMN1; SMN2 (0.36) ALDH1A1MAPK1SMN1; SMN2
SCHEMBL2800557 0.89 KDM4E (0.37) ALDH1A1MAPK1SMN1; SMN2
SCHEMBL2801434 0.87 MCHR2 (0.38) ALDH1A1MAPK1CBX7
SCHEMBL2800821 0.86 ALDH1A1 (0.39) ALDH1A1MAPK1CBX7SMN1; SMN2
SCHEMBL2803186 0.85 FASN (0.38) ALDH1A1CBX7
SCHEMBL2800033 0.83 ALDH1A1 (0.43) ALDH1A1MAPK1SMN1; SMN2
SCHEMBL2803993 0.83 CBX7 (0.35) ALDH1A1MAPK1CBX7
SCHEMBL2798475 0.83 PRSS1 (0.37) ALDH1A1
SCHEMBL2802170 0.82 FASN (0.41) ALDH1A1MAPK1SMN1; SMN2
SCHEMBL2801755 0.79 PDE4B (0.37) ALDH1A1CBX7SMN1; 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 ALDH1A1 243/4885MAPK1 389/4885CBX7 1145/4885

“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.