SCHEMBL2803202

SCHEMBL2803202

Cc1cc(F)ccc1Nc1c(C(=O)N2CCC3(CC2)COc2cccc(F)c23)cnc2c(C(=O)O)cnn12

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
F11 P03951 1/20 0.35
PDE4B Q07343 2/20 0.35
MAPT P10636 1/20 0.34
ALDH1A1 P00352 5/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
MAPK1 P28482 1/20 0.33
KDM4C Q9H3R0 1/20 0.33

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
SCHEMBL2801500 0.92 ALDH1A1 (0.37) PDE4BMAPTALDH1A1SMN1; SMN2
SCHEMBL2799530 0.90 IDO1 (0.36) F11PDE4BALDH1A1SMN1; SMN2MAPK1
SCHEMBL2803993 0.90 CBX7 (0.35) ALDH1A1MAPK1
SCHEMBL2802357 0.90 PDE4B (0.35) PDE4BMAPTALDH1A1SMN1; SMN2MAPK1
SCHEMBL2799126 0.85 PRSS1 (0.39) PDE4BALDH1A1
SCHEMBL2802330 0.82 IDO1 (0.36) MAPTALDH1A1
SCHEMBL2802251 0.82 TP53 (0.36) F11MAPTALDH1A1SMN1; SMN2
SCHEMBL2799803 0.82 PDE4B (0.38) F11PDE4BALDH1A1SMN1; SMN2MAPK1
SCHEMBL2801665 0.82 RBP4 (0.46) PDE4BALDH1A1SMN1; SMN2MAPK1
SCHEMBL2799661 0.82 KDM4E (0.38) PDE4BMAPTALDH1A1SMN1; 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 F11 2117/4885PDE4B 1603/4885MAPT 2533/4885

“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.