SCHEMBL19260720

SCHEMBL19260720

Clc1c2ccccc2nc2cc(OCCCN3CCCC3)ccc12

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 16/20 0.54
KCNH2 Q12809 8/20 0.54
ADRA1A P35348 4/20 0.54
ACP1 P24666 1/20 0.54
TLR9 Q9NR96 1/20 0.54
XDH P47989 1/20 0.53
HRH1 P35367 1/20 0.52
KDM4E B2RXH2 1/20 0.52
ALDH1A1 P00352 1/20 0.52
SMN1; SMN2 Q16637 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
SCHEMBL19260636 0.88 HRH3 (0.56) HRH3KCNH2ADRA1AACP1TLR9
SCHEMBL19260828 0.85 HRH3 (0.54) HRH3KCNH2ADRA1AACP1TLR9
SCHEMBL19260827 0.84 ACP1 (0.57) HRH3KCNH2ADRA1AACP1TLR9
SCHEMBL19260628 0.82 ACP1 (0.55) HRH3KCNH2ADRA1AACP1TLR9
SCHEMBL19260717 0.81 ACP1 (0.54) HRH3KCNH2ACP1TLR9ALDH1A1
SCHEMBL19260666 0.81 TLR7 (0.59) ACP1TLR9
SCHEMBL19260555 0.81 ACP1 (0.54) HRH3KCNH2ACP1TLR9ALDH1A1
Trifluoroacetic Acid SCHEMBL19260825 0.81 HRH3 (0.53) HRH3KCNH2ADRA1AKDM4EALDH1A1
SCHEMBL20504539 0.81 KDM4E (0.54) HRH3KCNH2TLR9KDM4EALDH1A1
SCHEMBL19260694 0.80 SPIN1 (0.58) ACP1TLR9

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-11254651-B2 Histone methyltransferase inhibitors GLOBAL BLOOD THERAPEUTICS, INC. (US) 2022-02-22 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
EP-3416963-B1 HISTONE METHYLTRANSFERASE INHIBITORS GLOBAL BLOOD THERAPEUTICS INC (US) 2021-07-28 EP disclosed
US-20190047981-A1 HISTONE METHYLTRANSFERASE INHIBITORS GLOBAL BLOOD THERAPEUTICS, INC. 2019-02-14 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 (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-20190047981-A1 HISTONE METHYLTRANSFERASE INHIBITORS EHMT1, EHMT2, BMI1 HRH3 1038/4885KCNH2 2770/4885ADRA1A 3721/4885
US-11254651-B2 Histone methyltransferase inhibitors EHMT1, EHMT2, BMI1 HRH3 1038/4885KCNH2 2770/4885ADRA1A 3721/4885

“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.