SCHEMBL2800917

SCHEMBL2800917

Cc1cc(F)ccc1Nc1c(C(=O)N2CCC3(CC2)COc2c(F)cccc23)cnc2c(C(=O)NS(=O)(=O)C3CC3)cnn12

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.34
ALDH1A1 P00352 4/20 0.33
SCN9A Q15858 4/20 0.33
SCN5A Q14524 2/20 0.33
SCN2B O60939 1/20 0.33
SCN1A P35498 1/20 0.33
SCN1B Q07699 1/20 0.33
PKLR P30613 1/20 0.32
LTB4R Q15722 2/20 0.32
PLAT P00750 1/20 0.31

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
SCHEMBL2803208 0.91 ALDH1A1 (0.32) ALDH1A1SCN9ASCN5ASCN2BSCN1A
SCHEMBL2802357 0.89 PDE4B (0.35) SMN1; SMN2ALDH1A1PKLR
SCHEMBL2801140 0.87 ALDH1A1 (0.35) SMN1; SMN2ALDH1A1SCN9ASCN5ASCN2B
SCHEMBL2800486 0.87 ALDH1A1 (0.35) SMN1; SMN2ALDH1A1SCN9ASCN5ASCN2B
SCHEMBL2798480 0.85 ALDH1A1 (0.37) SMN1; SMN2ALDH1A1
SCHEMBL2800359 0.84 SMN1; SMN2 (0.37) SMN1; SMN2ALDH1A1SCN9A
SCHEMBL2800835 0.84 MCHR2 (0.34) SMN1; SMN2ALDH1A1
SCHEMBL2801429 0.83 ALDH1A1 (0.32) ALDH1A1SCN9ASCN5ASCN2BSCN1B
SCHEMBL2803095 0.83 AVPR1A (0.37) SMN1; SMN2ALDH1A1SCN9ASCN5A
SCHEMBL2803993 0.82 CBX7 (0.35) ALDH1A1

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 SMN1; SMN2 2769/4885ALDH1A1 243/4885SCN9A 815/4885

“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.