SCHEMBL2802170

SCHEMBL2802170

CCS(=O)(=O)NC(=O)c1cnn2c(Nc3ccc(F)cc3C)c(C(=O)N3CCC(c4ccc(F)cc4)CC3)cnc12

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FASN P49327 7/20 0.41
ALDH1A1 P00352 3/20 0.38
PLAT P00750 1/20 0.37
GPBAR1 Q8TDU6 1/20 0.36
EGLN1 Q9GZT9 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
MAPK1 P28482 1/20 0.35
HTR7 P34969 1/20 0.35
GRIN1 Q05586 1/20 0.35
GRIN2B Q13224 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
SCHEMBL2800033 0.96 ALDH1A1 (0.43) FASNALDH1A1PLATEGLN1SMN1; SMN2
SCHEMBL2803803 0.91 FASN (0.40) FASNALDH1A1
SCHEMBL2801670 0.90 FASN (0.39) FASNALDH1A1GPBAR1EGLN1
SCHEMBL2803140 0.88 FASN (0.39) FASNALDH1A1GPBAR1EGLN1SMN1; SMN2
SCHEMBL2800139 0.88 FASN (0.42) FASNALDH1A1PLATEGLN1SMN1; SMN2
SCHEMBL2801754 0.88 ALDH1A1 (0.42) ALDH1A1EGLN1SMN1; SMN2
SCHEMBL2800918 0.87 KDM4E (0.42) FASNALDH1A1SMN1; SMN2
SCHEMBL2803213 0.87 NPC1 (0.40) FASNALDH1A1
SCHEMBL2801081 0.87 KDR (0.39) FASNALDH1A1GPBAR1EGLN1
SCHEMBL2803186 0.87 FASN (0.38) FASNALDH1A1

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160008362-A1 AGENT FOR PREVENTING AND/OR TREATING OCULAR INFLAMMATORY DISEASE KYOWA HAKKO KIRIN CO., LTD. (JP) 2016-01-14 US claimed
EP-2962692-A1 AGENT FOR PREVENTING AND/OR TREATING OCULAR INFLAMMATORY DISEASE Kyowa Hakko Kirin Co., Ltd. (JP) 2016-01-06 EP claimed
US-8729264-B2 Agent for prevention and/or treatment of skin diseases KYOWA HAKKO KIRIN CO., LTD. (JP) 2014-05-20 US claimed
US-20160008362-A1 AGENT FOR PREVENTING AND/OR TREATING OCULAR INFLAMMATORY DISEASE KYOWA HAKKO KIRIN CO., LTD. (JP) 2016-01-14 US disclosed
EP-2962692-A1 AGENT FOR PREVENTING AND/OR TREATING OCULAR INFLAMMATORY DISEASE Kyowa Hakko Kirin Co., Ltd. (JP) 2016-01-06 EP disclosed
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 (2 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-20160008362-A1 AGENT FOR PREVENTING AND/OR TREATING OCULAR INFLAMMATORY DISEASE NR0B1, NR2E3, NR0B2 FASN 2967/4885ALDH1A1 1026/4885PLAT 4779/4885
US-20100256134-A1 AGENT FOR PREVENTION AND/OR TREATMENT OF SKIN DISEASES TYR, CUTA, SERPINB1 FASN 4286/4885ALDH1A1 243/4885PLAT 1506/4885

“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.