SCHEMBL13744480

SCHEMBL13744480

CN(Cc1ccccn1)[C@H]1CC[C@H](C)CC1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ MAPT P10636 1/20 0.46
▸ LIN28A Q9H9Z2 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ RAB9A P51151 1/20 0.44
▸ MCHR1 Q99705 1/20 0.41
▸ SLC6A2 P23975 2/20 0.41
▸ SLC6A4 P31645 2/20 0.41
▸ SLC6A3 Q01959 2/20 0.41
▸ HRH3 Q9Y5N1 2/20 0.40
▸ TSHR P16473 1/20 0.40
▸ CHRM2 P08172 1/20 0.40
▸ CHRM4 P08173 1/20 0.40
▸ OPRM1 P35372 1/20 0.40
▸ OPRD1 P41143 1/20 0.40
▸ OPRK1 P41145 1/20 0.40
▸ KCNA5 P22460 1/20 0.40
▸ OGA O60502 1/20 0.39
▸ KMT2A Q03164 1/20 0.39

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
SCHEMBL17297961 1.00 SMN1; SMN2 (0.46) SMN1; SMN2MAPTLIN28ATDP1RAB9A
SCHEMBL17297790 1.00 SMN1; SMN2 (0.46) SMN1; SMN2MAPTLIN28ATDP1RAB9A
SCHEMBL17888208 0.94 TDP1 (0.52) SMN1; SMN2MAPTLIN28ATDP1RAB9A
SCHEMBL17376555 0.87 TSHR (0.51) SMN1; SMN2MAPTLIN28ATDP1RAB9A
SCHEMBL19195010 0.86 TDP1 (0.45) SMN1; SMN2MAPTLIN28ATDP1RAB9A
SCHEMBL10508730 0.86 RAB9A (0.46) SMN1; SMN2MAPTLIN28ATDP1RAB9A
SCHEMBL19477704 0.86 TDP1 (0.45) SMN1; SMN2MAPTLIN28ATDP1RAB9A
SCHEMBL10508734 0.86 RAB9A (0.46) SMN1; SMN2MAPTLIN28ATDP1RAB9A
SCHEMBL3122498 0.86 TSHR (0.50) SMN1; SMN2MAPTLIN28ATDP1RAB9A
SCHEMBL19102403 0.85 TDP1 (0.44) SMN1; SMN2MAPTLIN28ATDP1RAB9A

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 29 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200361914-A1 SUBSTITUTED BENZENE AND 6,5-FUSED BICYCLIC HETEROARYL COMPOUNDS Epizyme, Inc. 2020-11-19 — — US disclosed
EP-2935214-B1 1,4-PYRIDONE COMPOUNDS EPIZYME INC (US) 2019-02-20 — — EP disclosed
US-20180208591-A1 SUBSTITUTED 6,5-FUSED BICYCLIC HETEROARYL COMPOUNDS Epizyme, Inc. 2018-07-26 — — US disclosed
US-20180208591-A1 SUBSTITUTED 6,5-FUSED BICYCLIC HETEROARYL COMPOUNDS Epizyme, Inc. 2018-07-26 — — US disclosed
US-20180134692-A1 1,4-PYRIDONE BICYCLIC HETEROARYL COMPOUNDS Epizyme, Inc. 2018-05-17 — — US disclosed
US-20180134692-A1 1,4-PYRIDONE BICYCLIC HETEROARYL COMPOUNDS Epizyme, Inc. 2018-05-17 — — US disclosed
US-20180065954-A1 SUBSTITUTED 6,5-FUSED BICYCLIC HETEROARYL COMPOUNDS Epizyme, Inc. 2018-03-08 — — US disclosed
US-20180065954-A1 SUBSTITUTED 6,5-FUSED BICYCLIC HETEROARYL COMPOUNDS Epizyme, Inc. 2018-03-08 — — US disclosed
EP-2935264-B1 1,4-PYRIDONE BICYCLIC HETEROARYL COMPOUNDS EPIZYME INC (US) 2017-10-18 — — EP disclosed
US-9776996-B2 Substituted 6,5-fused bicyclic heteroaryl compounds Epizyme, Inc. (US) 2017-10-03 — — US disclosed
US-20160194316-A1 SUBSTITUTED BENZENE COMPOUNDS Epizyme, Inc. 2016-07-07 — — US disclosed
US-20160152604-A1 SUBSTITUTED 6,5-FUSED BICYCLIC HETEROARYL COMPOUNDS Epizyme, Inc. 2016-06-02 — — US disclosed
US-20160031907-A1 Substituted Benzene Compounds Epizyme, Inc. 2016-02-04 — — US disclosed
US-20160031907-A1 Substituted Benzene Compounds Epizyme, Inc. 2016-02-04 — — US disclosed
US-20160024081-A1 Substituted 6,5-Fused Bicyclic Heteroaryl Compounds Epizyme, Inc. 2016-01-28 — — US disclosed
US-20150344427-A1 1,4-PYRIDONE COMPOUNDS Epizyme, Inc. (US) 2015-12-03 — — US disclosed
US-20150344459-A1 1,4-PYRIDONE BICYCLIC HETEROARYL COMPOUNDS Epizyme, Inc. 2015-12-03 — — US disclosed
US-20150344459-A1 1,4-PYRIDONE BICYCLIC HETEROARYL COMPOUNDS Epizyme, Inc. 2015-12-03 — — US disclosed
US-20090209511-A1 Benzofuran Derivatives KAWAGUCHI TAKAYUKI 2009-08-20 — — US disclosed
US-20090209511-A1 Benzofuran Derivatives KAWAGUCHI TAKAYUKI 2009-08-20 — — 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 (11 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-20150344459-A1 1,4-PYRIDONE BICYCLIC HETEROARYL COMPOUNDS CYP4B1, PDXK, CYP1B1 SMN1; SMN2 2930/4885MAPT 4124/4885LIN28A 4694/4885
US-20160024081-A1 Substituted 6,5-Fused Bicyclic Heteroaryl Compounds CYP3A5, PAICS, CYP4B1 SMN1; SMN2 4624/4885MAPT 4172/4885LIN28A 4458/4885
US-20180134692-A1 1,4-PYRIDONE BICYCLIC HETEROARYL COMPOUNDS CYP4B1, PDXK, CYP1B1 SMN1; SMN2 2930/4885MAPT 4124/4885LIN28A 4694/4885
US-20160031907-A1 Substituted Benzene Compounds CYP1B1, CYP4B1, CYP2B6 SMN1; SMN2 2439/4885MAPT 4438/4885LIN28A 4167/4885
US-20150344427-A1 1,4-PYRIDONE COMPOUNDS PDXK, PNPO, PLPBP SMN1; SMN2 2354/4885MAPT 3910/4885LIN28A 4726/4885
US-20160152604-A1 SUBSTITUTED 6,5-FUSED BICYCLIC HETEROARYL COMPOUNDS H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, CYP3A5, PAICS SMN1; SMN2 3597/4885MAPT 4252/4885LIN28A 3920/4885
US-20180065954-A1 SUBSTITUTED 6,5-FUSED BICYCLIC HETEROARYL COMPOUNDS H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, CYP3A5, PAICS SMN1; SMN2 3597/4885MAPT 4252/4885LIN28A 3920/4885
US-20090209511-A1 Benzofuran Derivatives F12, F2, F3 SMN1; SMN2 3067/4885MAPT 4681/4885LIN28A 4466/4885
US-20200361914-A1 SUBSTITUTED BENZENE AND 6,5-FUSED BICYCLIC HETEROARYL COMPOUNDS BCOR, CYP2B6, AHR SMN1; SMN2 3952/4885MAPT 4625/4885LIN28A 3768/4885
US-20180208591-A1 SUBSTITUTED 6,5-FUSED BICYCLIC HETEROARYL COMPOUNDS CYP3A5, PAICS, CYP4B1 SMN1; SMN2 4624/4885MAPT 4172/4885LIN28A 4458/4885
US-20160194316-A1 SUBSTITUTED BENZENE COMPOUNDS CYP1B1, TP53, VHL SMN1; SMN2 2744/4885MAPT 4181/4885LIN28A 3925/4885

“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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