SCHEMBL15330247

SCHEMBL15330247

Cn1ccnc1-c1ccc(B(O)O)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 2/20 0.44
CA2 P00918 3/20 0.42
LPL P06858 2/20 0.42
LIPG Q9Y5X9 2/20 0.42
CA1 P00915 2/20 0.39
MGLL Q99685 1/20 0.39
KDM5B Q9UGL1 1/20 0.38
BRD4 O60885 1/20 0.37
PDK1 Q15118 1/20 0.36
CCNC P24863 1/20 0.36
CDK8 P49336 1/20 0.36
EDNRA P25101 1/20 0.36
KDM4E B2RXH2 1/20 0.36
NPC1 O15118 1/20 0.36
PKM P14618 1/20 0.36
RAB9A P51151 1/20 0.36
LPO P22079 1/20 0.35
NMT1 P30419 1/20 0.34
ENPP2 Q13822 2/20 0.34
ESR1 P03372 1/20 0.34

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
SCHEMBL9451409 0.79 HDAC4 (0.47) HDAC4KDM5BBRD4PDK1CCNC
SCHEMBL10194263 0.79 KDM4E (0.51) HDAC4KDM5BBRD4PDK1CCNC
SCHEMBL3462133 0.76 HDAC4 (0.46) HDAC4KDM5BBRD4CCNCCDK8
SCHEMBL9281044 0.76 HDAC4 (0.54) HDAC4BRD4PDK1CCNCCDK8
SCHEMBL16628325 0.76 HDAC4 (0.43) HDAC4KDM5BBRD4PDK1CCNC
SCHEMBL2326291 0.76 IDO1 (0.47) HDAC4KDM5BBRD4CCNCCDK8
SCHEMBL10558737 0.76 NR1H2 (0.45) HDAC4KDM5BBRD4KDM4ENPC1
SCHEMBL77337 0.76 HDAC4 (0.47) HDAC4KDM5BBRD4CCNCCDK8
SCHEMBL21776938 0.75 HDAC4 (0.50) HDAC4KDM5BBRD4PDK1EDNRA
SCHEMBL27031386 0.75 HDAC4 (0.44) HDAC4KDM5BBRD4PDK1CCNC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025133961-A1 NITROGEN-CONTAINING HETEROARYL COMPOUNDS FOR THE TREATMENT OF CHRONIC DISEASES PFIZER INC. (US) 2025-06-26 WO disclosed
EP-4313967-A1 KHK INHIBITORS GILEAD SCIENCES, INC. (US) 2024-02-07 EP disclosed
CN-117120429-A KHK inhibitor 吉利德科学公司 2023-11-24 CN disclosed
US-11767302-B2 Reagents and methods for tetrazine synthesis UNIVERSITY OF DELAWARE (US) 2023-09-26 US disclosed
US-11767302-B2 Reagents and methods for tetrazine synthesis UNIVERSITY OF DELAWARE (US) 2023-09-26 US disclosed
US-11767302-B2 Reagents and methods for tetrazine synthesis UNIVERSITY OF DELAWARE (US) 2023-09-26 US disclosed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
WO-2022212194-A1 KHK INHIBITORS GILEAD SCIENCES, INC. (US) 2022-10-06 WO disclosed
US-20220106278-A1 REAGENTS AND METHODS FOR TETRAZINE SYNTHESIS UNIVERSITY OF DELAWARE (US) 2022-04-07 US disclosed
US-11225655-B2 Bi-functional complexes and methods for making and using such complexes NUEVOLUTION A/S (DK) 2022-01-18 US disclosed
EP-3540059-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2019-09-18 EP disclosed
EP-2558577-B1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION AS (DK) 2018-12-12 EP disclosed
US-20130281324-A1 BI-FUNCTINAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2013-10-24 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-11767302-B2 Reagents and methods for tetrazine synthesis TST, CYP4F8, CYP4Z1 HDAC4 1822/4885CA2 2171/4885LPL 3408/4885
US-20220106278-A1 REAGENTS AND METHODS FOR TETRAZINE SYNTHESIS TST, CYP4F8, CYP4Z1 HDAC4 1822/4885CA2 2171/4885LPL 3408/4885

“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.