SCHEMBL2800424

SCHEMBL2800424

Cc1cc(F)ccc1Nc1c(C(=O)N2CCC3(CC2)CSc2ccccc23)cnc2c(C(=O)O)cnn12

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.36
PDE4B Q07343 2/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
MAPK1 P28482 1/20 0.35
MAPT P10636 1/20 0.34
TP53 P04637 1/20 0.33
CLK1 P49759 1/20 0.33
RBP4 P02753 1/20 0.33
MAPK13 O15264 1/20 0.33
MAPK12 P53778 1/20 0.33
MAPK11 Q15759 1/20 0.33
MAPK14 Q16539 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
SCHEMBL2798544 0.92 KDM4E (0.37) ALDH1A1SMN1; SMN2MAPK1MAPT
SCHEMBL2801665 0.89 RBP4 (0.46) ALDH1A1PDE4BSMN1; SMN2MAPK1RBP4
SCHEMBL2800486 0.89 ALDH1A1 (0.35) ALDH1A1SMN1; SMN2MAPTCLK1RBP4
SCHEMBL2799803 0.84 PDE4B (0.38) ALDH1A1PDE4BSMN1; SMN2MAPK1
SCHEMBL2802357 0.84 PDE4B (0.35) ALDH1A1PDE4BSMN1; SMN2MAPK1MAPT
SCHEMBL2800771 0.84 SMN1; SMN2 (0.36) ALDH1A1PDE4BSMN1; SMN2MAPK1MAPT
SCHEMBL2801869 0.84 MCHR2 (0.37) ALDH1A1PDE4BSMN1; SMN2MAPK1
SCHEMBL2799530 0.83 IDO1 (0.36) ALDH1A1PDE4BSMN1; SMN2MAPK1
SCHEMBL2799126 0.83 PRSS1 (0.39) ALDH1A1PDE4B
SCHEMBL2800541 0.82 FASN (0.39)

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 243/4885PDE4B 1603/4885SMN1; SMN2 2769/4885

“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.