SCHEMBL14059758

SCHEMBL14059758

Clc1c[nH]c2ccncc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 3/20 0.51
▸ DYRK1A Q13627 3/20 0.51
▸ HTR6 P50406 2/20 0.51
▸ NFATC1 O95644 2/20 0.51
▸ ACHE P22303 3/20 0.42
▸ IMPDH2 P12268 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ PIM1 P11309 3/20 0.39
▸ HASPIN Q8TF76 3/20 0.39
▸ CCNT1 O60563 2/20 0.39
▸ CDK9 P50750 2/20 0.39
▸ CHUK O15111 1/20 0.39
▸ GPR84 Q9NQS5 1/20 0.38
▸ CCNK O75909 1/20 0.38
▸ CCNE1 P24864 1/20 0.38
▸ CDK2 P24941 1/20 0.38
▸ CDK7 P50613 1/20 0.38
▸ CCNH P51946 1/20 0.38

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
SCHEMBL21917255 0.83 DYRK1A (0.66) GSK3BDYRK1AHTR6NFATC1PIM1
SCHEMBL30067091 0.75 HASPIN (0.59) GSK3BDYRK1AHTR6NFATC1ACHE
SCHEMBL2050489 0.75 HASPIN (0.59) GSK3BDYRK1AHTR6NFATC1ACHE
SCHEMBL10587 0.75 PIM1 (0.59) GSK3BDYRK1AHTR6NFATC1ACHE
SCHEMBL3224448 0.75 ATM (0.52) GSK3BDYRK1AHTR6NFATC1ACHE
SCHEMBL16168495 0.75 HTR6 (0.56) GSK3BDYRK1AHTR6NFATC1ACHE
SCHEMBL30295197 0.75 PIM1 (0.59) GSK3BDYRK1AHTR6NFATC1ACHE
SCHEMBL29535106 0.75 ATM (0.52) GSK3BDYRK1AHTR6NFATC1ACHE
SCHEMBL12326967 0.74 DYRK1A (0.56) GSK3BDYRK1AHTR6NFATC1IMPDH2
Hydrochloric Acid SCHEMBL30176075 0.73 HTR6 (0.54) GSK3BDYRK1AHTR6NFATC1ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9364466-B2 Heterocyclic compounds as protein kinase inhibitors DAIICHI SANKYO COMPANY, LIMITED (JP) 2016-06-14 — — US disclosed
EP-2714688-B1 HETEROCYCLIC COMPOUNDS AS PROTEIN KINASE INHIBITORS DAIICHI SANKYO CO LTD (JP) 2016-02-24 — — EP disclosed
US-20150157613-A1 HETEROCYCLIC COMPOUNDS AS PROTEIN KINASE INHIBITORS DAIICHI SANKYO COMPANY, LIMITED (JP) 2015-06-11 — — US disclosed
US-8980911-B2 Heterocyclic compounds as protein kinase inhibitors DAIICHI SANKYO COMPANY, LIMITED (JP) 2015-03-17 — — US disclosed
US-20140155398-A1 HETEROCYCLIC COMPOUNDS AS PROTEIN KINASE INHIBITORS DAIICHI SANKYO COMPANY, LIMITED (JP) 2014-06-05 — — US disclosed
WO-2012160464-A1 HETEROCYCLIC COMPOUNDS AS PROTEIN KINASE INHIBITORS DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-11-29 — — 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-20150157613-A1 HETEROCYCLIC COMPOUNDS AS PROTEIN KINASE INHIBITORS MAP3K1, JAK2, AKT1 GSK3B 305/4885DYRK1A 680/4885HTR6 4111/4885
US-20140155398-A1 HETEROCYCLIC COMPOUNDS AS PROTEIN KINASE INHIBITORS MAP3K1, JAK2, AKT1 GSK3B 305/4885DYRK1A 680/4885HTR6 4111/4885

“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.

Send feedback