SCHEMBL24345366

SCHEMBL24345366

COc1cc(C(C)C)cc2nccnc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
FGFR2 P21802 1/20 0.37
PDGFRB P09619 1/20 0.36
PDGFRA P16234 1/20 0.36
HDAC4 P56524 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
CCNB2 O95067 4/20 0.33
CDK1 P06493 4/20 0.33
CCNB1 P14635 4/20 0.33
GSK3A P49840 4/20 0.33
GSK3B P49841 4/20 0.33
CCNB3 Q8WWL7 4/20 0.33
ALDH1A1 P00352 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
CRHR1 P34998 1/20 0.33
HPGD P15428 1/20 0.33
ATM Q13315 1/20 0.33
CDK5 Q00535 3/20 0.33
CDK5R1 Q15078 3/20 0.33

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
SCHEMBL20049255 0.77 CSF1R (0.36) PDGFRBPDGFRAHDAC4HDAC8ALDH1A1
SCHEMBL20049120 0.76 EGFR (0.33) PDGFRBPDGFRAHDAC4HDAC8ALDH1A1
SCHEMBL25709549 0.76 PRMT5 (0.37) OGA
SCHEMBL13054409 0.76 FABP4 (0.42) ALDH1A1
SCHEMBL20666239 0.75 DYRK1A (0.48) MEN1KMT2APDGFRBPDGFRASMN1; SMN2
SCHEMBL24345363 0.75 SYK (0.59) FGFR2PDGFRBPDGFRAHDAC4HDAC8
SCHEMBL26128227 0.74 NQO2 (0.53) MEN1KMT2APDGFRBPDGFRACCNB2
SCHEMBL23847800 0.73 CCR1 (0.43) FGFR2HDAC4HDAC8GSK3AGSK3B
SCHEMBL24529570 0.70 MEN1 (0.38) MEN1KMT2APDGFRBPDGFRACCNB2
SCHEMBL19893002 0.69 CA12 (0.53) MEN1KMT2APDGFRBPDGFRAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230125803-A1 ANTIVIRAL HETEROCYCLIC COMPOUNDS ENANTA PHARM INC (US) 2023-04-27 US disclosed
US-11572367-B2 Antiviral heterocyclic compounds ENANTA PHARMACEUTICALS, INC. (US) 2023-02-07 US disclosed
US-20220119398-A1 HETEROCYCLIC COMPOUNDS AS ANTI-VIRAL AGENTS ENANTA PHARMACEUTICALS, INC. 2022-04-21 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 (3 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-20220119398-A1 HETEROCYCLIC COMPOUNDS AS ANTI-VIRAL AGENTS VIP, ACE, FURIN MEN1 1492/4885KMT2A 2438/4885FGFR2 3061/4885
US-11572367-B2 Antiviral heterocyclic compounds ACE, HPRT1, ACE2 MEN1 1038/4885KMT2A 2570/4885FGFR2 4035/4885
US-20230125803-A1 ANTIVIRAL HETEROCYCLIC COMPOUNDS ACE, HPRT1, ACE2 MEN1 1038/4885KMT2A 2570/4885FGFR2 4035/4885

“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.