SCHEMBL2286272

SCHEMBL2286272

CSc1nc(Cl)c(C(=O)N(CC2CCCN2C(=O)OC(C)(C)C)c2cccc(-c3nn(C)c(=O)o3)c2)c(Cl)n1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ F2RL3 Q96RI0 2/20 0.38
▸ USP30 Q70CQ3 6/20 0.37
▸ UCHL1 P09936 1/20 0.37
▸ TSHR P16473 4/20 0.36
▸ LMNA P02545 3/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ POLB P06746 1/20 0.35
▸ MAPT P10636 2/20 0.34
▸ NPSR1 Q6W5P4 2/20 0.34
▸ GPR119 Q8TDV5 2/20 0.34
▸ PDE7B Q9NP56 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ KMT2A Q03164 1/20 0.34

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 1.00 F2RL3 (0.38) F2RL3USP30UCHL1TSHRLMNA
SCHEMBL2286280 0.88 USP30 (0.37) F2RL3USP30UCHL1TSHRLMNA
SCHEMBL2290600 0.75 USP30 (0.43) F2RL3USP30TSHRLMNAALDH1A1
SCHEMBL2290596 0.75 USP30 (0.43) F2RL3USP30TSHRLMNAALDH1A1
SCHEMBL15142037 0.71 ALDH1A1 (0.36) F2RL3USP30UCHL1TSHRLMNA
SCHEMBL15142039 0.71 ALDH1A1 (0.36) F2RL3USP30UCHL1TSHRLMNA
SCHEMBL5106523 0.69 USP30 (0.43) USP30
SCHEMBL5106527 0.69 USP30 (0.43) USP30
SCHEMBL2288684 0.68 OPRD1 (0.43) TSHRLMNAALDH1A1PDE7BMEN1
SCHEMBL2288690 0.68 OPRD1 (0.43) TSHRLMNAALDH1A1PDE7BMEN1

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 F2RL3 3799/4885USP30 4680/4885UCHL1 4785/4885

“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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