SCHEMBL30100699

SCHEMBL30100699

CC1(C)Cc2ccccc2NC1=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 2/20 0.48
AHR P35869 1/20 0.48
BRD4 O60885 3/20 0.47
CREBBP Q92793 2/20 0.47
NPC1 O15118 2/20 0.47
MAPK13 O15264 1/20 0.47
MAPK12 P53778 1/20 0.47
MAPK11 Q15759 1/20 0.47
MAPK14 Q16539 1/20 0.47
PDK4 Q16654 1/20 0.47
OTUD7B Q6GQQ9 1/20 0.44
MAPT P10636 3/20 0.44
PPARG P37231 2/20 0.40
RXFP1 Q9HBX9 2/20 0.40
NCOR2 Q9Y618 2/20 0.40
PRNP P04156 1/20 0.40
KDM4E B2RXH2 2/20 0.39
MEN1 O00255 1/20 0.39
HSP90AA1 P07900 1/20 0.39
THRB P10828 1/20 0.39

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
SCHEMBL6220027 1.00 PDK2 (0.48) PDK2AHRBRD4CREBBPNPC1
SCHEMBL10693042 0.81 PDK2 (0.46) PDK2AHRBRD4CREBBPNPC1
SCHEMBL5999181 0.81 NPC1 (0.53) PDK2AHRBRD4CREBBPNPC1
SCHEMBL23674847 0.78 NPSR1 (0.52) PDK2AHRBRD4CREBBPNPC1
SCHEMBL30100714 0.78 NPSR1 (0.52) PDK2AHRBRD4CREBBPNPC1
SCHEMBL14828445 0.77 CYP3A4 (0.46) BRD4OTUD7BKDM4EMEN1KMT2A
SCHEMBL5242583 0.77 PDK2 (0.44) PDK2PDK4MAPTKDM4EMEN1
SCHEMBL9194873 0.77 PDK2 (0.42) PDK2AHRBRD4CREBBPNPC1
SCHEMBL14941425 0.76 OTUD7B (0.59) PDK2AHRBRD4CREBBPNPC1
SCHEMBL24569636 0.76 PDK2 (0.44) PDK2AHRBRD4CREBBPNPC1

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-20250161281-A1 EMOPAMIL-BINDING PROTEIN INHIBITORS AND USES THEREOF BIOGEN MA INC. 2025-05-22 US disclosed
CN-117157072-A Novel cyclopento [ c ] pyrrole NR2B negative allosteric modulators 诺华股份有限公司 2023-12-01 CN disclosed
EP-4093400-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF The Trustees of Princeton University (US) 2022-11-30 EP 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 (1 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-20250161281-A1 EMOPAMIL-BINDING PROTEIN INHIBITORS AND USES THEREOF EBPL, EBP, CREBBP PDK2 2468/4885AHR 4769/4885BRD4 309/4885

“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.