SCHEMBL7753402

SCHEMBL7753402

N#Cc1ccc(N2CCC(CC(=O)O)CC2)cc1

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 6/20 0.52
SIGMAR1 Q99720 1/20 0.51
CHRM4 P08173 2/20 0.51
POLB P06746 1/20 0.48
KDM4E B2RXH2 1/20 0.47
TP53 P04637 1/20 0.47
DPP4 P27487 1/20 0.47
CTSS P25774 1/20 0.46
CTSK P43235 1/20 0.46
FFAR2 O15552 1/20 0.45
CHRNA10 Q9GZZ6 1/20 0.44
CHRNA9 Q9UGM1 1/20 0.44
USP30 Q70CQ3 1/20 0.43
SYK P43405 1/20 0.43

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
Trifluoroacetic Acid SCHEMBL1026186 0.92 FFAR4 (0.54) FFAR4SIGMAR1CHRM4POLBKDM4E
SCHEMBL9176367 0.81 KDM4E (0.53) SIGMAR1CHRM4POLBKDM4ETP53
SCHEMBL7753345 0.81 USP14 (0.52) FFAR4SIGMAR1CHRM4KDM4ETP53
SCHEMBL2557268 0.81 FFAR4 (0.61) FFAR4CHRM4
SCHEMBL321690 0.80 NOTUM (0.58) CHRM4POLBKDM4ETP53DPP4
SCHEMBL132858 0.80 FFAR4 (0.53) FFAR4POLBKDM4ETP53SYK
SCHEMBL26373077 0.80 FFAR4 (0.55) FFAR4
SCHEMBL20271745 0.80 NOTUM (0.56) FFAR4SIGMAR1CHRM4POLBKDM4E
SCHEMBL20271742 0.80 NOTUM (0.56) FFAR4
SCHEMBL13622620 0.80 KCNH2 (0.55) CHRM4DPP4USP30

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8871753-B2 Macrocyclic compounds and their use as kinase inhibitors INCYTE CORPORATION (US) 2014-10-28 US disclosed
US-8871753-B2 Macrocyclic compounds and their use as kinase inhibitors INCYTE CORPORATION (US) 2014-10-28 US disclosed
US-20090286778-A1 MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS INCYTE CORPORATION (US) 2009-11-19 US disclosed
US-20090286778-A1 MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS INCYTE CORPORATION (US) 2009-11-19 US disclosed
CN-1076345-C 2,3-diaminopropionic acid derivative SUMITOMO PHARMA (JP) 2001-12-19 CN disclosed
EP-0725059-B1 2,3-DIAMINOPROPIONIC ACID DERIVATIVE SUMITOMO PHARMA (JP) 2001-01-17 EP disclosed
US-6048854-A ANTICOAGULANTS; ANTICANCER AGENT; WOUND HEALING AGENTS;BONE DISORDERS SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2000-04-11 US disclosed
US-5707994-A USEFUL AS A PLATELET AGGREGATION INHIBITOR, CANCER METASTASIS INHIBITOR, WOUND HEALING AGENT OR A BONE RESORPTION INHIBITOR SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1998-01-13 US disclosed
CN-1138322-A 2,3-diaminopropionic acid derivative SUMITOMO PHARMA (JP) 1996-12-18 CN disclosed
EP-0725059-A1 2,3-DIAMINOPROPIONIC ACID DERIVATIVE SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1996-08-07 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-20090286778-A1 MACROCYCLIC COMPOUNDS AND THEIR USE AS KINASE INHIBITORS JAK2, JAK1, ALK FFAR4 2075/4885SIGMAR1 3483/4885CHRM4 4834/4885

“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.