SCHEMBL25530147

SCHEMBL25530147

CC(C)(C)C(=O)c1ccnn1C1CCC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.40
NR3C2 P08235 1/20 0.40
PDK2 Q15119 2/20 0.39
PDK1 Q15118 1/20 0.39
KMT2A Q03164 3/20 0.39
BRD4 O60885 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
LMNA P02545 1/20 0.37
GAA P10253 1/20 0.36
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34
ALOX15 P16050 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
HCAR3 P49019 1/20 0.34
CTSK P43235 1/20 0.33
MAPK13 O15264 1/20 0.33
MAPK12 P53778 1/20 0.33
MAPK11 Q15759 1/20 0.33
MAPK14 Q16539 1/20 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
SCHEMBL25854000 0.94 PDK2 (0.43) PKMNR3C2PDK2PDK1KMT2A
SCHEMBL25564438 0.82 CNR2 (0.39) PDK2PDK1KMT2ABRD4
SCHEMBL25522013 0.82 PKM (0.42) PKMNR3C2PDK2PDK1KMT2A
SCHEMBL25562704 0.81 SMN1; SMN2 (0.36) PKMNR3C2PDK2PDK1KMT2A
SCHEMBL25071115 0.81 ALDH1A1 (0.41) PKMNR3C2PDK2PDK1KMT2A
SCHEMBL26396444 0.80 NR3C2 (0.46) PKMNR3C2KMT2ABRD4SMN1; SMN2
SCHEMBL22637999 0.80 HCAR3 (0.43) PKMNR3C2PDK2PDK1KMT2A
SCHEMBL22637763 0.78 KMT2A (0.46) PKMNR3C2KMT2ABRD4SMN1; SMN2
SCHEMBL25083966 0.78 KMT2A (0.44) PKMNR3C2KMT2ABRD4SMN1; SMN2
SCHEMBL22637693 0.77 KMT2A (0.46) PKMNR3C2KMT2ABRD4SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230227437-A1 IMMUNOMODULATOR HITGEN INC (CN) 2023-07-20 US disclosed
US-20230227437-A1 IMMUNOMODULATOR HITGEN INC (CN) 2023-07-20 US disclosed
US-20230159465-A1 IMMUNOMODULATOR HITGEN INC. (CN) 2023-05-25 US disclosed
EP-4183783-A1 IMMUNOMODULATOR Hitgen Inc. (CN) 2023-05-24 EP disclosed
EP-4177249-A1 IMMUNOMODULATOR Hitgen Inc. (CN) 2023-05-10 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 (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-20230159465-A1 IMMUNOMODULATOR IL2, IL17A, IL2RA PKM 4644/4885NR3C2 289/4885PDK2 2977/4885
US-20230227437-A1 IMMUNOMODULATOR IL17A, IL2, IL2RA PKM 4673/4885NR3C2 281/4885PDK2 2452/4885

“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.