SCHEMBL2286280

SCHEMBL2286280

Cc1nc(Cl)c(C(=S)N(C[C@@H]2CCCN2C(=O)OC(C)(C)C)c2cccc(-c3nn(C)c(=O)o3)c2)c(Cl)n1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ USP30 Q70CQ3 6/20 0.37
▸ UCHL1 P09936 1/20 0.37
▸ OPRD1 P41143 1/20 0.36
▸ TSHR P16473 3/20 0.35
▸ LMNA P02545 2/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ F2RL3 Q96RI0 2/20 0.34
▸ MAPT P10636 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ GPR119 Q8TDV5 2/20 0.34
▸ DPP4 P27487 1/20 0.33
▸ POLB P06746 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
SCHEMBL2286265 0.88 F2RL3 (0.38) USP30UCHL1TSHRLMNAALDH1A1
SCHEMBL2286272 0.88 F2RL3 (0.38) USP30UCHL1TSHRLMNAALDH1A1
SCHEMBL2290596 0.75 USP30 (0.43) USP30OPRD1TSHRLMNAALDH1A1
SCHEMBL2290600 0.75 USP30 (0.43) USP30OPRD1TSHRLMNAALDH1A1
SCHEMBL5106523 0.67 USP30 (0.43) USP30
SCHEMBL5106527 0.67 USP30 (0.43) USP30
SCHEMBL5107240 0.63 PDE4D (0.42) USP30
SCHEMBL5107233 0.63 PDE4D (0.42) USP30
SCHEMBL2545927 0.62 RIPK1 (0.46) USP30UCHL1OPRD1GPR119
SCHEMBL4199082 0.61 FFAR1 (0.47) USP30UCHL1OPRD1

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 4680/4885UCHL1 4785/4885OPRD1 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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