SCHEMBL19260705

SCHEMBL19260705

COc1cc(C(=O)O)c(N)cc1OCCCN1CCCC1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR4 Q13639 6/20 0.56
CYP3A4 P08684 2/20 0.56
MEN1 O00255 1/20 0.56
ALDH1A1 P00352 1/20 0.56
CYP2D6 P10635 1/20 0.56
HTR3A P46098 1/20 0.56
KMT2A Q03164 1/20 0.56
EHMT2 Q96KQ7 9/20 0.56
EHMT1 Q9H9B1 7/20 0.56
SPIN1 Q9Y657 3/20 0.50
GLA P06280 1/20 0.50
ACHE P22303 1/20 0.50

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
SCHEMBL17375537 0.92 HTR4 (0.47) HTR4CYP3A4MEN1ALDH1A1CYP2D6
SCHEMBL2926517 0.90 HTR4 (0.56) HTR4CYP3A4MEN1ALDH1A1CYP2D6
SCHEMBL19260656 0.89 KDM4E (0.59) HTR4CYP3A4MEN1ALDH1A1CYP2D6
Hydrochloric Acid SCHEMBL2925147 0.89 HTR4 (0.57) HTR4CYP3A4MEN1ALDH1A1CYP2D6
SCHEMBL4379114 0.88 HTR4 (0.60) HTR4CYP3A4MEN1ALDH1A1CYP2D6
SCHEMBL20028142 0.86 EHMT2 (0.67) HTR4CYP3A4MEN1ALDH1A1CYP2D6
SCHEMBL6336768 0.85 HTR4 (0.62) HTR4CYP3A4MEN1ALDH1A1CYP2D6
SCHEMBL2235600 0.84 KDM4E (0.56) MEN1ALDH1A1KMT2A
SCHEMBL28745107 0.84 HTR4 (0.50) HTR4CYP3A4MEN1ALDH1A1CYP2D6
SCHEMBL18089590 0.83 KDM4E (0.54) MEN1ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
WO-2019036384-A1 TRICYCLIC COMPOUNDS AS HISTONE METHYLTRANSFERASE INHIBITORS GLOBAL BLOOD THERAPEUTICS, INC. (US) 2019-02-21 WO 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 HTR4 3486/4885CYP3A4 4515/4885MEN1 678/4885
US-11584734-B2 Tricyclic compounds as histone methyltransferase inhibitors EHMT1, EHMT2, BMI1 HTR4 3234/4885CYP3A4 4215/4885MEN1 616/4885
US-11254651-B2 Histone methyltransferase inhibitors EHMT1, EHMT2, BMI1 HTR4 3486/4885CYP3A4 4515/4885MEN1 678/4885
US-20200361896-A1 TRICYCLIC COMPOUNDS AS HISTONE METHYLTRANSFERASE INHIBITORS EHMT1, EHMT2, BMI1 HTR4 3234/4885CYP3A4 4215/4885MEN1 616/4885

“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.