SCHEMBL20028142

SCHEMBL20028142

COc1cc(N)c(N)cc1OCCCN1CCCC1

nearest known ligand 0.67

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EHMT2 Q96KQ7 11/20 0.67
EHMT1 Q9H9B1 8/20 0.67
SPIN1 Q9Y657 5/20 0.59
HTR4 Q13639 2/20 0.54
MEN1 O00255 2/20 0.54
ALDH1A1 P00352 2/20 0.54
CYP2D6 P10635 2/20 0.54
KMT2A Q03164 2/20 0.54
CYP3A4 P08684 1/20 0.54
HTR3A P46098 1/20 0.54
CYP1A2 P05177 1/20 0.52

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
SCHEMBL20028123 0.88 EHMT2 (0.58) EHMT2EHMT1SPIN1HTR4MEN1
SCHEMBL13355148 0.86 EHMT2 (0.56) EHMT2EHMT1SPIN1HTR4MEN1
SCHEMBL2926517 0.86 HTR4 (0.56) EHMT2EHMT1SPIN1HTR4MEN1
SCHEMBL19260705 0.86 HTR4 (0.56) EHMT2EHMT1SPIN1HTR4MEN1
Hydrochloric Acid SCHEMBL2925147 0.85 HTR4 (0.57) EHMT2EHMT1SPIN1HTR4MEN1
SCHEMBL19260656 0.85 KDM4E (0.59) EHMT2EHMT1SPIN1HTR4MEN1
SCHEMBL20028146 0.85 EHMT2 (0.55) EHMT2EHMT1SPIN1HTR4MEN1
SCHEMBL17372611 0.84 EHMT2 (0.60) EHMT2EHMT1SPIN1MEN1ALDH1A1
SCHEMBL1930155 0.84 EHMT2 (0.60) EHMT2EHMT1SPIN1MEN1ALDH1A1
SCHEMBL19462226 0.84 EHMT2 (0.64) EHMT2EHMT1SPIN1MEN1ALDH1A1

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
EP-4105203-A1 SPIRO-CONDENSED INDOLE COMPOUNDS AS EHMT2 INHIBITORS Epizyme Inc (US) 2022-12-21 EP disclosed
US-20220274961-A1 SUBSTITUTED FUSED BI- OR TRI- HETEROCYCLIC COMPOUNDS AS EHMT2 INHIBITORS Epizyme, Inc. 2022-09-01 US disclosed
EP-3519393-B1 SUBSTITUTED FUSED BI- OR TRI- HETEROCYCLIC COMPOUNDS AS EHMT2 INHIBITORS EPIZYME INC (US) 2022-05-18 EP disclosed
EP-3519393-B1 SUBSTITUTED FUSED BI- OR TRI- HETEROCYCLIC COMPOUNDS AS EHMT2 INHIBITORS EPIZYME INC (US) 2022-05-18 EP disclosed
US-20200039961-A1 SUBSTITUTED FUSED BI- OR TRI- HETEROCYCLIC COMPOUNDS AS EHMT2 INHIBITORS Epizyme, Inc. 2020-02-06 US disclosed
US-20200039961-A1 SUBSTITUTED FUSED BI- OR TRI- HETEROCYCLIC COMPOUNDS AS EHMT2 INHIBITORS Epizyme, Inc. 2020-02-06 US disclosed
EP-3519393-A1 SUBSTITUTED FUSED BI- OR TRI- HETEROCYCLIC COMPOUNDS AS EHMT2 INHIBITORS Epizyme Inc (US) 2019-08-07 EP disclosed
WO-2018064557-A1 SUBSTITUTED FUSED BI- OR TRI- HETEROCYCLIC COMPOUNDS AS EHMT2 INHIBITORS Epizyme, Inc. (US) 2018-04-05 WO disclosed
WO-2018064557-A1 SUBSTITUTED FUSED BI- OR TRI- HETEROCYCLIC COMPOUNDS AS EHMT2 INHIBITORS Epizyme, Inc. (US) 2018-04-05 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 (2 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-20200039961-A1 SUBSTITUTED FUSED BI- OR TRI- HETEROCYCLIC COMPOUNDS AS EHMT2 INHIBITORS SHMT1, BHMT, EHMT2 EHMT2 3/4885EHMT1 4/4885SPIN1 1040/4885
US-20220274961-A1 SUBSTITUTED FUSED BI- OR TRI- HETEROCYCLIC COMPOUNDS AS EHMT2 INHIBITORS SHMT1, BHMT, EHMT2 EHMT2 3/4885EHMT1 4/4885SPIN1 1040/4885

“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.