SCHEMBL20967313

SCHEMBL20967313

C/N=C(C)/C=C(\N)NC(=O)C1CCC(N)CC1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 1/20 0.32
NPC1 O15118 1/20 0.30
MAPT P10636 1/20 0.30
MAPK1 P28482 1/20 0.30
RAB9A P51151 1/20 0.30
TLR2 O60603 1/20 0.30
ROCK2 O75116 1/20 0.30

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
SCHEMBL24344113 0.66 KMT2A (0.41) POLBHTTKMT2A
SCHEMBL21013922 0.66 NPC1 (0.30) NPC1MAPTMAPK1RAB9A
SCHEMBL3211286 0.66 CHRNB2 (0.42) POLBHTTKMT2ATLR2
SCHEMBL1563436 0.66 CHRNB2 (0.42) POLBHTTKMT2ATLR2
SCHEMBL19054663 0.66 CHRNB2 (0.42) POLBHTTKMT2ATLR2
Hydrochloric Acid SCHEMBL25329031 0.64 CHRNB2 (0.41) POLBHTTKMT2ATLR2
Hydrochloric Acid SCHEMBL25329033 0.64 CHRNB2 (0.41) POLBHTTKMT2ATLR2
SCHEMBL28898687 0.64 HDAC8 (0.48) POLBMAPK1RAB9A
SCHEMBL16335635 0.63 TLR2 (0.42) POLBHTTNPC1RAB9ATLR2
SCHEMBL16335638 0.63 TLR2 (0.42) POLBHTTNPC1RAB9ATLR2

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-10703748-B2 Diazanaphthalen-3-yl carboxamides and preparation and use thereof SAMUMED, LLC (US) 2020-07-07 US disclosed
US-20190127370-A1 DIAZANAPHTHALEN-3-YL CARBOXAMIDES AND PREPARATION AND USE THEREOF VICKERS-SPLICE CO-INVESTMENT LLC (KY) 2019-05-02 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-20190127370-A1 DIAZANAPHTHALEN-3-YL CARBOXAMIDES AND PREPARATION AND USE THEREOF DYRK1A, DKK1, WNT1 POLB 3427/4885HTT 1428/4885KMT2A 1066/4885
US-10703748-B2 Diazanaphthalen-3-yl carboxamides and preparation and use thereof DYRK1A, DKK1, WNT1 POLB 3427/4885HTT 1428/4885KMT2A 1066/4885

“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.