SCHEMBL21743155

SCHEMBL21743155

CCN1CC[C@@H](COC(C)C)C1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 6/20 0.38
DRD2 P14416 1/20 0.35
DRD3 P35462 1/20 0.35
TP53 P04637 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
MAPK1 P28482 1/20 0.35
MEN1 O00255 1/20 0.34
PMP22 Q01453 1/20 0.34
KMT2A Q03164 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.32
HRH3 Q9Y5N1 2/20 0.31
KCNA3 P22001 1/20 0.31

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
SCHEMBL21667895 1.00 CHRM3 (0.38) CHRM3DRD2DRD3TP53CYP1A2
SCHEMBL17212848 1.00 CHRM3 (0.38) CHRM3DRD2DRD3TP53CYP1A2
SCHEMBL26314849 0.89 CYP3A4 (0.35) DRD2DRD3CYP1A2CYP3A4CYP2D6
SCHEMBL23330488 0.89 SMN1; SMN2 (0.37) SMN1; SMN2HRH3KCNA3
SCHEMBL21667902 0.84
SCHEMBL24477279 0.82 SLC6A4 (0.33)
SCHEMBL23023334 0.81 GPR119 (0.35) MAPK1MEN1KMT2ASMN1; SMN2KCNA3
SCHEMBL21429859 0.80 CHRM3 (0.41) CHRM3DRD2DRD3TP53CYP1A2
SCHEMBL12188157 0.80 CHRM3 (0.41) CHRM3DRD2DRD3TP53CYP1A2
SCHEMBL26879986 0.80 CHRM3 (0.41) CHRM3DRD2DRD3TP53CYP1A2

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 11 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
US-20230364086-A1 COMBINATION THERAPIES WITH EHMT2 INHIBITORS Epizyme, Inc. 2023-11-16 US disclosed
US-11672800-B2 Combination therapies with EHMT2 inhibitors Epizyme, Inc. (US) 2023-06-13 US disclosed
US-11672800-B2 Combination therapies with EHMT2 inhibitors Epizyme, Inc. (US) 2023-06-13 US disclosed
US-11339160-B2 Imidazole and triazole containing bicyclic compounds as JAK inhibitors THERAVANCE BIOPHARMA R&D IP, LLC (US) 2022-05-24 US disclosed
EP-3519393-B1 SUBSTITUTED FUSED BI- OR TRI- HETEROCYCLIC COMPOUNDS AS EHMT2 INHIBITORS EPIZYME INC (US) 2022-05-18 EP disclosed
US-20210213014-A1 METHODS OF USING EHMT2 INHIBITORS IN IMMUNOTHERAPIES Epizyme, Inc. 2021-07-15 US disclosed
US-20210040085-A1 IMIDAZOLE AND TRIAZOLE CONTAINING BICYCLIC COMPOUNDS AS JAK INHIBITORS THERAVANCE BIOPHARMA R&D IP, LLC (US) 2021-02-11 US disclosed
US-20200317642-A1 AMINE-SUBSTITUTED HETEROCYCLIC COMPOUNDS AS EHMT2 INHIBITORS AND DERIVATIVES THEREOF Epizyme, Inc. 2020-10-08 US disclosed
US-20200113901-A1 METHODS OF USING EHMT2 INHIBITORS Epizyme, Inc. 2020-04-16 US disclosed
US-20200054635-A1 COMBINATION THERAPIES WITH EHMT2 INHIBITORS Epizyme, Inc. 2020-02-20 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 (8 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 CHRM3 4139/4885DRD2 4815/4885DRD3 4857/4885
US-20200317642-A1 AMINE-SUBSTITUTED HETEROCYCLIC COMPOUNDS AS EHMT2 INHIBITORS AND DERIVATIVES THEREOF HNMT, EHMT2, SHMT2 CHRM3 2797/4885DRD2 3681/4885DRD3 4433/4885
US-11339160-B2 Imidazole and triazole containing bicyclic compounds as JAK inhibitors JAK3, JAK1, JAK2 CHRM3 3623/4885DRD2 2946/4885DRD3 1387/4885
US-20210040085-A1 IMIDAZOLE AND TRIAZOLE CONTAINING BICYCLIC COMPOUNDS AS JAK INHIBITORS JAK3, JAK1, JAK2 CHRM3 3623/4885DRD2 2946/4885DRD3 1387/4885
US-20200054635-A1 COMBINATION THERAPIES WITH EHMT2 INHIBITORS EHMT2, BHMT, SHMT2 CHRM3 4139/4885DRD2 4815/4885DRD3 4857/4885
US-20200113901-A1 METHODS OF USING EHMT2 INHIBITORS EHMT2, EHMT1, BHMT CHRM3 3609/4885DRD2 4507/4885DRD3 4613/4885
US-11672800-B2 Combination therapies with EHMT2 inhibitors EHMT2, BHMT, SHMT2 CHRM3 4139/4885DRD2 4815/4885DRD3 4857/4885
US-20210213014-A1 METHODS OF USING EHMT2 INHIBITORS IN IMMUNOTHERAPIES EHMT2, BHMT2, BHMT CHRM3 4324/4885DRD2 4704/4885DRD3 4762/4885

“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.