SCHEMBL2801458

SCHEMBL2801458

CCOC(=O)c1cnn2c(Nc3cc(C)ccc3F)c(C(=O)N3CCC(c4ccc5ccccc5c4)CC3)cnc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.39
HSD17B10 Q99714 5/20 0.39
ALDH1A1 P00352 4/20 0.39
HPGD P15428 4/20 0.39
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
GUCY1A1 Q02108 7/20 0.37
GUCY1B1 Q02153 7/20 0.37
RECQL P46063 1/20 0.37
TSHR P16473 2/20 0.36
MEN1 O00255 1/20 0.36
USP2 O75604 1/20 0.36
KMT2A Q03164 1/20 0.36
KDR P35968 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TP53 P04637 1/20 0.36
CASP1 P29466 1/20 0.36
CASP7 P55210 1/20 0.36
CDK1 P06493 1/20 0.35
CDK4 P11802 1/20 0.35

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
SCHEMBL2802831 0.92 KDM4E (0.40) KDM4EHSD17B10ALDH1A1HPGDNPC1
SCHEMBL2800543 0.91 EGLN1 (0.37) KDM4EHSD17B10ALDH1A1HPGDNPC1
SCHEMBL2799695 0.91 KDM4E (0.41) KDM4EHSD17B10ALDH1A1HPGDNPC1
SCHEMBL2799696 0.90 TP53 (0.41) KDM4EHSD17B10ALDH1A1HPGDNPC1
SCHEMBL2802313 0.88 EGLN1 (0.35) KDM4EHSD17B10ALDH1A1HPGDNPC1
SCHEMBL2800599 0.88 KDM4E (0.39) KDM4EHSD17B10ALDH1A1HPGDNPC1
SCHEMBL2800942 0.85 TP53 (0.40) KDM4EHSD17B10ALDH1A1HPGDNPC1
SCHEMBL2800432 0.85 KDM4E (0.41) KDM4EHSD17B10ALDH1A1HPGDNPC1
SCHEMBL2798931 0.83 SPR (0.41) KDM4EHSD17B10ALDH1A1HPGDNPC1
SCHEMBL2801655 0.83 ALDH1A1 (0.41) KDM4EALDH1A1NPC1RAB9AMEN1

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 KDM4E 3180/4885HSD17B10 1881/4885ALDH1A1 243/4885

“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.