SCHEMBL22987084

SCHEMBL22987084

CCC(CC)(NC(=O)c1cc(C)c(N)c(C)c1)C(=O)OC

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 7/20 0.37
CNR1 P21554 5/20 0.37
HTT P42858 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
TAS1R3 Q7RTX0 4/20 0.34
TAS1R1 Q7RTX1 4/20 0.34
PTGER4 P35408 2/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33

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
SCHEMBL22987134 0.85 KDM4E (0.34) CNR2CNR1HTTL3MBTL1KDM4E
SCHEMBL22987087 0.81 ALDH1A1 (0.46) HTTL3MBTL1SMN1; SMN2PTGER4KDM4E
SCHEMBL22987109 0.79 NPC1 (0.44) CNR2CNR1SMN1; SMN2KDM4EALDH1A1
SCHEMBL8048655 0.71 HTT (0.33) HTTL3MBTL1SMN1; SMN2ALDH1A1
SCHEMBL22987071 0.70 ESR1 (0.40) HTTSMN1; SMN2TAS1R3TAS1R1PTGER4
SCHEMBL9593911 0.69 HPGD (0.36) CNR2CNR1HTTL3MBTL1SMN1; SMN2
SCHEMBL27461280 0.69 PKM (0.37) CNR2CNR1HTTL3MBTL1KDM4E
SCHEMBL8863114 0.69 P2RX7 (0.41) HTTSMN1; SMN2TAS1R3TAS1R1KDM4E
SCHEMBL1005961 0.68 HDAC6 (0.43) HTTSMN1; SMN2KDM4EALDH1A1
SCHEMBL5787161 0.68 CA12 (0.54) CNR2L3MBTL1KDM4EALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3586838-B1 AMIDE DERIVATIVE DAIICHI SANKYO CO LTD (JP) 2021-10-27 EP disclosed
EP-3586838-B1 AMIDE DERIVATIVE DAIICHI SANKYO CO LTD (JP) 2021-10-27 EP disclosed
US-10925848-B2 Amide derivative DAIICHI SANKYO COMPANY, LIMITED (JP) 2021-02-23 US disclosed
US-10925848-B2 Amide derivative DAIICHI SANKYO COMPANY, LIMITED (JP) 2021-02-23 US disclosed
CN-110325184-A Amide derivatives 第一三共株式会社 2019-10-11 CN 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-10925848-B2 Amide derivative IDO1, IDO2, TPH1 CNR2 102/4885CNR1 88/4885HTT 1462/4885

“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.