SCHEMBL13145353

SCHEMBL13145353

CC(C)OCC(O)CN1CCCC1

nearest known ligand 0.71

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.69
KMT2A Q03164 4/20 0.56
MEN1 O00255 3/20 0.56
ATM Q13315 2/20 0.52
MAPT P10636 1/20 0.52
POLB P06746 2/20 0.51
CYP2D6 P10635 2/20 0.50
CYP2C19 P33261 1/20 0.50
KDM4E B2RXH2 2/20 0.49
TSHR P16473 1/20 0.47
HIF1A Q16665 1/20 0.47
USP2 O75604 1/20 0.47
HTT P42858 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
ACE2 Q9BYF1 1/20 0.46
ABCB1 P08183 2/20 0.46

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
SCHEMBL21941854 1.00 SMN1; SMN2 (0.69) SMN1; SMN2KMT2AMEN1ATMMAPT
SCHEMBL21743267 1.00 SMN1; SMN2 (0.69) SMN1; SMN2KMT2AMEN1ATMMAPT
SCHEMBL13145355 0.98 SMN1; SMN2 (0.67) SMN1; SMN2KMT2AMEN1ATMMAPT
SCHEMBL21743274 0.96 SMN1; SMN2 (0.69) SMN1; SMN2KMT2AMEN1ATMMAPT
SCHEMBL18747350 0.96 SMN1; SMN2 (0.69) SMN1; SMN2KMT2AMEN1ATMMAPT
SCHEMBL23641970 0.96 SMN1; SMN2 (0.69) SMN1; SMN2KMT2AMEN1ATMMAPT
SCHEMBL3970208 0.92 SMN1; SMN2 (0.73) SMN1; SMN2KMT2AMEN1ATMMAPT
SCHEMBL3966966 0.92 SMN1; SMN2 (0.73) SMN1; SMN2KMT2AMEN1ATMMAPT
SCHEMBL4446649 0.92 SMN1; SMN2 (0.73) SMN1; SMN2KMT2AMEN1ATMMAPT
SCHEMBL23641998 0.85 KMT2A (0.52) SMN1; SMN2KMT2AMEN1ATMMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230364086-A1 COMBINATION THERAPIES WITH EHMT2 INHIBITORS Epizyme, Inc. 2023-11-16 US disclosed
WO-2023194458-A1 N-(3-(BENZO[B]THIOPHENE-2-CARBOXAMIDO)-PHENYL)-2,3-DIHYDROBENZO[B][1,4]DIOXINE-6-CARBOXAMIDE DERIVATIVES AND RELATED COMPOUNDS AS LACTATE/ATP PRODUCTION INHIBITORS FOR THE TREATMENT OF CANCER WMT AG (DE) 2023-10-12 WO disclosed
US-11672800-B2 Combination therapies with EHMT2 inhibitors Epizyme, Inc. (US) 2023-06-13 US disclosed
EP-3442947-B1 AMINE-SUBSTITUTED ARYL OR HETEROARYL COMPOUNDS AS EHMT1 AND EHMT2 INHIBITORS EPIZYME INC (US) 2023-06-07 EP disclosed
US-20200054635-A1 COMBINATION THERAPIES WITH EHMT2 INHIBITORS Epizyme, Inc. 2020-02-20 US disclosed
WO-2018064557-A1 SUBSTITUTED FUSED BI- OR TRI- HETEROCYCLIC COMPOUNDS AS EHMT2 INHIBITORS Epizyme, Inc. (US) 2018-04-05 WO disclosed
US-7795440-B2 N-substituted tricyclic 1-aminopyrazoles as inhibitors for the treatment of cell proliferative disorders JANSSEN PHARMACEUTICA NV (BE) 2010-09-14 US disclosed
US-20070142305-A1 N-substituted tricyclic 1-aminopyrazoles as inhibitors for the treatment of cell proliferative disorders HO CHIH Y 2007-06-21 US disclosed
US-7196110-B2 N-substituted tricyclic 3-aminopyrazoles as inhibitors for the treatment of cell proliferative disorders JANSSEN PHAMACEUTICA N.V. (BE) 2007-03-27 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 (4 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-20230364086-A1 COMBINATION THERAPIES WITH EHMT2 INHIBITORS EHMT2, BHMT, SHMT2 SMN1; SMN2 2231/4885KMT2A 35/4885MEN1 1229/4885
US-20070142305-A1 N-substituted tricyclic 1-aminopyrazoles as inhibitors for the treatment of cell proliferative disorders PDGFRA, PDGFRB, PDGFA SMN1; SMN2 3954/4885KMT2A 2557/4885MEN1 2796/4885
US-20200054635-A1 COMBINATION THERAPIES WITH EHMT2 INHIBITORS EHMT2, BHMT, SHMT2 SMN1; SMN2 2231/4885KMT2A 35/4885MEN1 1229/4885
US-11672800-B2 Combination therapies with EHMT2 inhibitors EHMT2, BHMT, SHMT2 SMN1; SMN2 2231/4885KMT2A 35/4885MEN1 1229/4885

“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.