SCHEMBL17632045

SCHEMBL17632045

O=C(Nc1nc2c(s1)CN(C(=O)c1ccccn1)CC2)C1CCNC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.47
▸ GAA P10253 2/20 0.47
▸ MAPT P10636 2/20 0.47
▸ RAB9A P51151 2/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ NPC1 O15118 1/20 0.47
▸ PARK7 Q99497 3/20 0.43
▸ UCHL1 P09936 3/20 0.43
▸ GRM5 P41594 8/20 0.42
▸ CHRNB2 P17787 1/20 0.41
▸ CHRNB4 P30926 1/20 0.41
▸ CHRNA3 P32297 1/20 0.41
▸ CHRNA7 P36544 1/20 0.41
▸ CHRNA4 P43681 1/20 0.41
▸ NPY5R Q15761 1/20 0.40
▸ EPHX2 P34913 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ PDGFRB P09619 1/20 0.40
▸ KDR P35968 1/20 0.40

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
SCHEMBL17632042 1.00 ALDH1A1 (0.47) ALDH1A1GAAMAPTRAB9ASMN1; SMN2
SCHEMBL17631964 0.84 ALDH1A1 (0.49) ALDH1A1GAAMAPTRAB9ASMN1; SMN2
SCHEMBL17631969 0.84 ALDH1A1 (0.49) ALDH1A1GAAMAPTRAB9ASMN1; SMN2
SCHEMBL19281699 0.82 UCHL1 (0.61) ALDH1A1GAAMAPTRAB9ASMN1; SMN2
SCHEMBL17631676 0.82 UCHL1 (0.61) ALDH1A1GAAMAPTRAB9ASMN1; SMN2
SCHEMBL17631556 0.81 GRM5 (0.45) ALDH1A1GAAMAPTRAB9ASMN1; SMN2
SCHEMBL17631554 0.81 GRM5 (0.45) ALDH1A1GAAMAPTRAB9ASMN1; SMN2
SCHEMBL17631678 0.80 GRM5 (0.41) ALDH1A1SMN1; SMN2GRM5CHRNB2CHRNB4
SCHEMBL21845568 0.79 GAA (0.44) ALDH1A1GAAMAPTRAB9ASMN1; SMN2
SCHEMBL22647668 0.78 ALDH1A1 (0.50) ALDH1A1GAAMAPTRAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11993595-B2 Compounds MISSION THERAPEUTICS LIMITED (GB) 2024-05-28 — — US disclosed
US-20230052191-A1 NOVEL COMPOUNDS MISSION THERAPEUTICS LTD (GB) 2023-02-16 — — US disclosed
US-11472798-B2 Compounds MISSION THERAPEUTICS LTD (GB) 2022-10-18 — — US disclosed
EP-3828179-A1 CYANOPYRROLIDINES AS DUB MODULATORS Mission Therapeutics Limited (GB) 2021-06-02 — — EP disclosed
US-20200369658-A1 NOVEL COMPOUNDS MISSION THERAPEUTICS LTD (GB) 2020-11-26 — — US disclosed
US-10774078-B2 Compounds MISSION THERAPEUTICS LTD (GB) 2020-09-15 — — US disclosed
EP-3197883-B1 NOVEL COMPOUNDS MISSION THERAPEUTICS LTD (GB) 2020-03-18 — — EP disclosed
US-20190330202-A1 NOVEL COMPOUNDS MISSION THERAPEUTICS LTD (GB) 2019-10-31 — — US disclosed
US-10392380-B2 Compounds MISSION THERAPEUTICS LIMITED (GB) 2019-08-27 — — US disclosed
US-20180162852-A1 NOVEL COMPOUNDS MISSION THERAPEUTICS LIMITED 2018-06-14 — — US disclosed
US-9926307-B2 Compounds MISSION THERAPEUTICS LTD (GB) 2018-03-27 — — US disclosed
US-20170247365-A1 NOVEL COMPOUNDS MISSION THERAPEUTICS LTD (GB) 2017-08-31 — — US disclosed
EP-3197883-A1 NOVEL COMPOUNDS Mission Therapeutics Limited (GB) 2017-08-02 — — EP disclosed
WO-2016046530-A1 NOVEL COMPOUNDS MISSION THERAPEUTICS LTD (GB) 2016-03-31 — — WO 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 (9 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-10774078-B2 Compounds UCHL1, UCHL3, UCHL5 ALDH1A1 300/4885GAA 455/4885MAPT 2227/4885
US-11472798-B2 Compounds UCHL1, UCHL3, UCHL5 ALDH1A1 300/4885GAA 455/4885MAPT 2227/4885
US-20180162852-A1 NOVEL COMPOUNDS UCHL1, UCHL3, UCHL5 ALDH1A1 285/4885GAA 402/4885MAPT 2428/4885
US-10392380-B2 Compounds UCHL1, UCHL3, UCHL5 ALDH1A1 300/4885GAA 455/4885MAPT 2227/4885
US-11993595-B2 Compounds UCHL1, UCHL3, UCHL5 ALDH1A1 300/4885GAA 455/4885MAPT 2227/4885
US-20200369658-A1 NOVEL COMPOUNDS UCHL1, UCHL3, UCHL5 ALDH1A1 285/4885GAA 402/4885MAPT 2428/4885
US-20190330202-A1 NOVEL COMPOUNDS UCHL1, UCHL3, UCHL5 ALDH1A1 285/4885GAA 402/4885MAPT 2428/4885
US-20170247365-A1 NOVEL COMPOUNDS UCHL1, UCHL3, UCHL5 ALDH1A1 285/4885GAA 402/4885MAPT 2428/4885
US-20230052191-A1 NOVEL COMPOUNDS UCHL1, UCHL3, UCHL5 ALDH1A1 285/4885GAA 402/4885MAPT 2428/4885

“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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