SCHEMBL2799384

SCHEMBL2799384

CCS(=O)(=O)NC(=O)c1cnn2c(Nc3cccc(C)c3F)c(C(=O)N3CCC(c4ccccc4)CC3)cnc12

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 1/20 0.38
ALDH1A1 P00352 5/20 0.38
FASN P49327 1/20 0.37
SPR P35270 3/20 0.36
EGLN1 Q9GZT9 1/20 0.36
POLB P06746 1/20 0.36
F11 P03951 1/20 0.36
PDE4B Q07343 1/20 0.35
TPSAB1 Q15661 3/20 0.35
SIRT5 Q9NXA8 1/20 0.35
MAPT P10636 1/20 0.34
OPRM1 P35372 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL2803213 0.93 NPC1 (0.40) NPC1RAB9AKMT2AALDH1A1FASN
SCHEMBL2802799 0.91 ALDH1A1 (0.40) NPC1RAB9AKMT2AALDH1A1FASN
SCHEMBL2800033 0.90 ALDH1A1 (0.43) NPC1RAB9AKMT2AALDH1A1FASN
SCHEMBL2800506 0.89 KMT2A (0.41) NPC1RAB9AKMT2AALDH1A1FASN
SCHEMBL2801762 0.89 EGLN1 (0.39) NPC1RAB9AKMT2AALDH1A1SPR
SCHEMBL2801637 0.89 SIRT5 (0.41) NPC1RAB9AALDH1A1FASNSPR
SCHEMBL2803776 0.89 SPR (0.38) KMT2AALDH1A1FASNSPRF11
SCHEMBL2801510 0.88 EGLN1 (0.38) ALDH1A1FASNSPREGLN1F11
SCHEMBL2800842 0.88 ALDH1A1 (0.38) NPC1RAB9AKMT2AALDH1A1FASN
SCHEMBL2800861 0.88 TP53 (0.39) NPC1RAB9AKMT2AALDH1A1FASN

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 NPC1 1787/4885RAB9A 3259/4885KMT2A 2175/4885

“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.