SCHEMBL19260641

SCHEMBL19260641

COc1cc2c(NC(C)C)c3ccccc3nc2cc1OCCCN1CCCC1

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CACNA2D1 P54289 1/20 0.58
EHMT2 Q96KQ7 13/20 0.55
DNMT1 P26358 4/20 0.55
EHMT1 Q9H9B1 6/20 0.54
SPIN1 Q9Y657 3/20 0.54
TLR9 Q9NR96 2/20 0.54
TLR7 Q9NYK1 2/20 0.54
ACP1 P24666 1/20 0.51

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
SCHEMBL20720593 0.93 CACNA2D1 (0.59) CACNA2D1EHMT2DNMT1EHMT1SPIN1
SCHEMBL19260700 0.93 CACNA2D1 (0.59) CACNA2D1EHMT2DNMT1EHMT1SPIN1
SCHEMBL19260776 0.93 CACNA2D1 (0.59) CACNA2D1EHMT2DNMT1EHMT1SPIN1
SCHEMBL19260556 0.93 SRC (0.56) EHMT2SPIN1
SCHEMBL19260688 0.92 EHMT2 (0.56) EHMT2DNMT1EHMT1SPIN1TLR9
SCHEMBL20720605 0.91 SPIN1 (0.56) EHMT2DNMT1EHMT1SPIN1TLR9
SCHEMBL19260819 0.89 CACNA2D1 (0.59) CACNA2D1EHMT2ACP1
SCHEMBL19260783 0.88 EHMT2 (0.51) CACNA2D1EHMT2DNMT1SPIN1TLR9
SCHEMBL19260768 0.88 EHMT2 (0.51) CACNA2D1EHMT2DNMT1SPIN1TLR9
SCHEMBL19260586 0.88 CACNA2D1 (0.58) CACNA2D1EHMT2DNMT1TLR9TLR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11254651-B2 Histone methyltransferase inhibitors GLOBAL BLOOD THERAPEUTICS, INC. (US) 2022-02-22 US claimed
EP-3416963-B1 HISTONE METHYLTRANSFERASE INHIBITORS GLOBAL BLOOD THERAPEUTICS INC (US) 2021-07-28 EP claimed
US-20190047981-A1 HISTONE METHYLTRANSFERASE INHIBITORS GLOBAL BLOOD THERAPEUTICS, INC. 2019-02-14 US claimed
US-11584734-B2 Tricyclic compounds as histone methyltransferase inhibitors GLOBAL BLOOD THERAPEUTICS, INC. (US) 2023-02-21 US disclosed
US-11254651-B2 Histone methyltransferase inhibitors GLOBAL BLOOD THERAPEUTICS, INC. (US) 2022-02-22 US disclosed
EP-3416963-B1 HISTONE METHYLTRANSFERASE INHIBITORS GLOBAL BLOOD THERAPEUTICS INC (US) 2021-07-28 EP disclosed
US-20200361896-A1 TRICYCLIC COMPOUNDS AS HISTONE METHYLTRANSFERASE INHIBITORS GLOBAL BLOOD THERAPEUTICS, INC. 2020-11-19 US disclosed
US-20190047981-A1 HISTONE METHYLTRANSFERASE INHIBITORS GLOBAL BLOOD THERAPEUTICS, INC. 2019-02-14 US disclosed
EP-3416963-A1 HISTONE METHYLTRANSFERASE INHIBITORS Global Blood Therapeutics, Inc. (US) 2018-12-26 EP disclosed
WO-2017142947-A1 HISTONE METHYLTRANSFERASE INHIBITORS GLOBAL BLOOD THERAPEUTICS, INC. (US) 2017-08-24 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 (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-20190047981-A1 HISTONE METHYLTRANSFERASE INHIBITORS EHMT1, EHMT2, BMI1 CACNA2D1 1539/4885EHMT2 2/4885DNMT1 32/4885
US-11584734-B2 Tricyclic compounds as histone methyltransferase inhibitors EHMT1, EHMT2, BMI1 CACNA2D1 771/4885EHMT2 2/4885DNMT1 24/4885
US-11254651-B2 Histone methyltransferase inhibitors EHMT1, EHMT2, BMI1 CACNA2D1 1539/4885EHMT2 2/4885DNMT1 32/4885
US-20200361896-A1 TRICYCLIC COMPOUNDS AS HISTONE METHYLTRANSFERASE INHIBITORS EHMT1, EHMT2, BMI1 CACNA2D1 771/4885EHMT2 2/4885DNMT1 24/4885

“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.