SCHEMBL19116540

SCHEMBL19116540

Cc1ncc(NC(=O)CC(C)C)cn1

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 2/20 0.59
▸ LMNA P02545 2/20 0.50
▸ HPGD P15428 2/20 0.50
▸ MAPK1 P28482 2/20 0.49
▸ MAPT P10636 1/20 0.49
▸ SMN1; SMN2 Q16637 5/20 0.49
▸ RAB9A P51151 4/20 0.47
▸ GAA P10253 2/20 0.47
▸ NPC1 O15118 3/20 0.46
▸ ALDH1A1 P00352 3/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ GFER P55789 1/20 0.46
▸ KDM4E B2RXH2 2/20 0.45
▸ TSHR P16473 1/20 0.45
▸ ADORA2A P29274 1/20 0.45
▸ F2R P25116 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ KMT2A Q03164 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
SCHEMBL19116501 0.86 PTPN1 (0.59) PTPN1LMNAHPGDMAPK1MAPT
SCHEMBL19116341 0.81 PTPN1 (0.67) PTPN1LMNAHPGDMAPK1MAPT
SCHEMBL19116840 0.81 PTPN1 (0.55) PTPN1LMNAHPGDMAPK1MAPT
SCHEMBL19116655 0.80 PTPN1 (0.54) PTPN1LMNAHPGDMAPK1MAPT
SCHEMBL19116502 0.80 PTPN1 (0.58) PTPN1LMNAHPGDMAPK1MAPT
SCHEMBL19151034 0.79 POLB (0.50) LMNAHPGDMAPK1MAPTSMN1; SMN2
SCHEMBL25443769 0.78 PTPN1 (0.67) PTPN1LMNAHPGDMAPK1MAPT
SCHEMBL8361578 0.78 PTPN1 (0.76) PTPN1LMNAHPGDMAPK1MAPT
SCHEMBL19116851 0.77 PTPN1 (0.65) PTPN1LMNAHPGDMAPK1MAPT
SCHEMBL31052440 0.77 PTPN1 (0.65) PTPN1LMNAHPGDMAPK1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230174540-A1 3-(Carboxymethyl)-8-Amino-2-Oxo-1,3-Diaza-Spiro-[4.5]-Decane Derivatives GRUENENTHAL GMBH (DE) 2023-06-08 — — US disclosed
US-20210179627-A1 3-(Carboxymethyl)-8-Amino-2-Oxo-1,3-Diaza-Spiro-[4.5]-Decane Derivatives Grünenthal GmbH (DE) 2021-06-17 — — US disclosed
US-20200399280-A1 3-(Carboxymethyl)-8-Amino-2-Oxo-1,3-Diaza-Spiro-[4.5]-Decane Derivatives Grünenthal GmbH (DE) 2020-12-24 — — US disclosed
US-10807989-B2 3-(carboxymethyl)-8-amino-2-oxo-1,3-diaza-spiro-[4.5]-decane derivatives Grünenthal GmbH (DE) 2020-10-20 — — US disclosed
US-20190106430-A1 3-(CARBOXYMETHYL)-8-AMINO-2-OXO-1,3-DIAZA-SPIRO-[4.5]-DECANE DERIVATIVES Grünenthal GmbH (DE) 2019-04-11 — — US disclosed
US-20170197971-A1 3-(Carboxymethyl)-8-Amino-2-Oxo-1,3-Diaza-Spiro-[4.5]-Decane Derivatives GRUENENTHAL GMBH (DE) 2017-07-13 — — US 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 (6 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-20190106430-A1 3-(CARBOXYMETHYL)-8-AMINO-2-OXO-1,3-DIAZA-SPIRO-[4.5]-DECANE DERIVATIVES OPRK1, OPRD1, PKD2 PTPN1 3524/4885LMNA 1276/4885HPGD 946/4885
US-20200399280-A1 3-(Carboxymethyl)-8-Amino-2-Oxo-1,3-Diaza-Spiro-[4.5]-Decane Derivatives OPRK1, OPRD1, PKD2 PTPN1 3524/4885LMNA 1276/4885HPGD 946/4885
US-20170197971-A1 3-(Carboxymethyl)-8-Amino-2-Oxo-1,3-Diaza-Spiro-[4.5]-Decane Derivatives OPRK1, OPRD1, PKD2 PTPN1 3524/4885LMNA 1276/4885HPGD 946/4885
US-10807989-B2 3-(carboxymethyl)-8-amino-2-oxo-1,3-diaza-spiro-[4.5]-decane derivatives OPRK1, OPRD1, PKD2 PTPN1 3524/4885LMNA 1276/4885HPGD 946/4885
US-20210179627-A1 3-(Carboxymethyl)-8-Amino-2-Oxo-1,3-Diaza-Spiro-[4.5]-Decane Derivatives OPRK1, OPRD1, PKD2 PTPN1 3524/4885LMNA 1276/4885HPGD 946/4885
US-20230174540-A1 3-(Carboxymethyl)-8-Amino-2-Oxo-1,3-Diaza-Spiro-[4.5]-Decane Derivatives OPRK1, OPRD1, PKD2 PTPN1 3524/4885LMNA 1276/4885HPGD 946/4885

“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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