SCHEMBL23700852

SCHEMBL23700852

COc1ccc(-c2nc3[nH]nc(N)c3cc2Cl)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.44
▸ DYRK1A Q13627 1/20 0.44
▸ ADORA2A P29274 1/20 0.44
▸ KMT2A Q03164 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ CDK4 P11802 1/20 0.43
▸ CCND1 P24385 1/20 0.43
▸ PRKAB2 O43741 1/20 0.42
▸ PRKAG1 P54619 1/20 0.42
▸ PRKAA2 P54646 1/20 0.42
▸ PRKAA1 Q13131 1/20 0.42
▸ PRKAG3 Q9UGI9 1/20 0.42
▸ PRKAG2 Q9UGJ0 1/20 0.42
▸ PRKAB1 Q9Y478 1/20 0.42
▸ GSK3A P49840 2/20 0.41
▸ GSK3B P49841 2/20 0.41
▸ MAPT P10636 1/20 0.41
▸ ACHE P22303 1/20 0.40
▸ HSP90AA1 P07900 1/20 0.40
▸ DPP4 P27487 1/20 0.40

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
SCHEMBL7257484 0.85 KDM4E (0.46) KDM4EDYRK1AADORA2AKMT2AMEN1
SCHEMBL7256732 0.84 KDM4E (0.44) KDM4EDYRK1AADORA2AKMT2AMEN1
SCHEMBL12692214 0.81 ADORA1 (0.49) KDM4EDYRK1AADORA2AKMT2AMEN1
SCHEMBL10333750 0.71 PDE3B (0.54) KDM4EKMT2AMEN1CDK4POLB
SCHEMBL2090637 0.71 NCF1 (0.47) KDM4EKMT2AMEN1MAPTPOLB
SCHEMBL7256520 0.70 MEN1 (0.47) KDM4EDYRK1AKMT2AMEN1CDK4
SCHEMBL6116321 0.70 BTK (0.69) DYRK1AACHE
SCHEMBL29930500 0.69 DYRK1A (0.47) KDM4EDYRK1AADORA2AKMT2AMEN1
SCHEMBL11940604 0.69 MEN1 (0.52) DYRK1AKMT2AMEN1GSK3AGSK3B
SCHEMBL3364101 0.68 JAK2 (0.66) DYRK1APRKAG1PRKAA1PRKAB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11773121-B2 Antiviral compounds VIROVAX LLC (US) 2023-10-03 — — US disclosed
US-20210238210-A1 ANTIVIRAL COMPOUNDS VIROVAX LLC 2021-08-05 — — US 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-20210238210-A1 ANTIVIRAL COMPOUNDS ZC3HAV1, SARS1, ZC3HAV1L KDM4E 2111/4885DYRK1A 3332/4885ADORA2A 1925/4885
US-11773121-B2 Antiviral compounds ZC3HAV1, SARS1, ZC3HAV1L KDM4E 2111/4885DYRK1A 3332/4885ADORA2A 1925/4885

“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