SCHEMBL15980403

SCHEMBL15980403

Cc1ncc2cn(C)nc2n1

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 3/20 0.34
ADORA2A P29274 2/20 0.34
ALDH1A1 P00352 2/20 0.33
KDM4E B2RXH2 1/20 0.32
NSD2 O96028 1/20 0.32
MAPT P10636 1/20 0.32
ADORA3 P0DMS8 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
SCHEMBL22001038 0.78 ADORA2A (0.41) ADORA1ADORA2AALDH1A1KDM4ENSD2
SCHEMBL31313980 0.73 FOS (0.33) ADORA1ADORA2AALDH1A1ADORA3
SCHEMBL21676523 0.71 ADORA1 (0.34) ADORA1ADORA2AALDH1A1KDM4ENSD2
SCHEMBL15980404 0.71 MAPT (0.36) ALDH1A1KDM4ENSD2MAPT
SCHEMBL15980358 0.69 CCR1 (0.47) ADORA1ADORA2AALDH1A1KDM4ENSD2
SCHEMBL15833604 0.68 MAPT (0.41) ADORA1ADORA2AALDH1A1KDM4ENSD2
SCHEMBL24121909 0.67 PDK2 (0.32)
SCHEMBL26723705 0.67 ADORA2A (0.46) ADORA1ADORA2AALDH1A1ADORA3
SCHEMBL16320778 0.64 ALDH1A1 (0.41) ALDH1A1
SCHEMBL22001420 0.64 PAK4 (0.46) ADORA1ADORA2AALDH1A1KDM4ENSD2

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-20250051319-A1 COMPOUNDS AND USE THEREOF AS HDAC6 INHIBITORS AUGUSTINE THERAPEUTICS (BE) 2025-02-13 US claimed
US-12421222-B2 Substituted quinazolines as HDAC6 inhibitors AUGUSTINE THERAPEUTICS (BE) 2025-09-23 US disclosed
US-20250145604-A1 COMPOUNDS AND USE THEREOF AS HDAC6 INHIBITORS AUGUSTINE THERAPEUTICS (BE) 2025-05-08 US disclosed
US-20250051319-A1 COMPOUNDS AND USE THEREOF AS HDAC6 INHIBITORS AUGUSTINE THERAPEUTICS (BE) 2025-02-13 US disclosed
US-9133129-B2 Bicyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-09-15 US disclosed
US-9133129-B2 Bicyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-09-15 US disclosed
US-20140243310-A1 BICYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-08-28 US disclosed
US-20140243310-A1 BICYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-08-28 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 (4 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-20250051319-A1 COMPOUNDS AND USE THEREOF AS HDAC6 INHIBITORS HDAC6, HDAC9, HDAC1 ADORA1 4645/4885ADORA2A 4698/4885ALDH1A1 608/4885
US-20250145604-A1 COMPOUNDS AND USE THEREOF AS HDAC6 INHIBITORS HDAC6, HDAC9, HDAC1 ADORA1 4645/4885ADORA2A 4698/4885ALDH1A1 608/4885
US-20140243310-A1 BICYCLIC COMPOUND BICRA, NR3C2, CYP11B2 ADORA1 2097/4885ADORA2A 2471/4885ALDH1A1 450/4885
US-12421222-B2 Substituted quinazolines as HDAC6 inhibitors HDAC6, HDAC9, HDAC1 ADORA1 4485/4885ADORA2A 4599/4885ALDH1A1 850/4885

“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.