SCHEMBL2290600

SCHEMBL2290600

Cn1nc(-c2cccc(NCC3CCCN3C(=O)OC(C)(C)C)c2)oc1=O

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ USP30 Q70CQ3 3/20 0.43
▸ POLB P06746 1/20 0.41
▸ OPRD1 P41143 1/20 0.40
▸ PRMT5 O14744 1/20 0.40
▸ FPR3 P25089 1/20 0.39
▸ FPR2 P25090 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ KDM1A O60341 1/20 0.39
▸ F2RL3 Q96RI0 2/20 0.39
▸ GPR119 Q8TDV5 2/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ LMNA P02545 2/20 0.38
▸ TSHR P16473 1/20 0.38
▸ EPHX2 P34913 1/20 0.38
▸ TP53 P04637 1/20 0.37
▸ GLA P06280 1/20 0.37

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
SCHEMBL2290596 1.00 USP30 (0.43) USP30POLBOPRD1PRMT5FPR3
SCHEMBL5100434 0.83 USP30 (0.49) USP30POLBOPRD1PRMT5FPR3
SCHEMBL5097195 0.83 USP30 (0.49) USP30POLBOPRD1PRMT5FPR3
SCHEMBL2542454 0.79 APP (0.49) POLBOPRD1PRMT5FPR3FPR2
SCHEMBL12311356 0.78 OPRD1 (0.53) USP30OPRD1PRMT5FPR3FPR2
SCHEMBL12479834 0.75 CFD (0.57) OPRD1PRMT5FPR3FPR2KDM1A
SCHEMBL12479831 0.75 CFD (0.57) OPRD1PRMT5FPR3FPR2KDM1A
SCHEMBL2286265 0.75 F2RL3 (0.38) USP30POLBMAPTNPSR1F2RL3
SCHEMBL2286280 0.75 USP30 (0.37) USP30POLBOPRD1MAPTNPSR1
SCHEMBL2286272 0.75 F2RL3 (0.38) USP30POLBMAPTNPSR1F2RL3

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-2163554-B1 PYRIMIDODIAZEPINONE DERIVATIVE KYOWA HAKKO KIRIN CO LTD (JP) 2012-08-01 — — EP disclosed
US-7998954-B2 Pyrimidodiazepinone derivative KYOWA HAKKO KIRIN CO., LTD. (JP) 2011-08-16 — — US disclosed
US-20100190775-A1 PYRIMIDODIAZEPINONE DERIVATIVE KYOWA HAKKO KIRIN CO., LTD (JP) 2010-07-29 — — US disclosed
EP-2163554-A1 PYRIMIDODIAZEPINONE DERIVATIVE Kyowa Hakko Kirin Co., Ltd. (JP) 2010-03-17 — — 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-20100190775-A1 PYRIMIDODIAZEPINONE DERIVATIVE KCNJ1, KCNJ11, ADRA1D USP30 4680/4885POLB 1331/4885OPRD1 21/4885

“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.

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