SCHEMBL25820139

SCHEMBL25820139

CC(=O)c1ccc2nccc(CC(C)C)c2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.47
TRPV1 Q8NER1 1/20 0.45
CCNC P24863 1/20 0.42
CDK8 P49336 1/20 0.42
MTNR1A P48039 3/20 0.41
MTNR1B P49286 3/20 0.41
ALDH1A1 P00352 9/20 0.41
KDM4E B2RXH2 4/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
L3MBTL1 Q9Y468 2/20 0.40
HPGD P15428 1/20 0.40
MAPT P10636 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 1/20 0.39
HIF1A Q16665 1/20 0.39
GAA P10253 1/20 0.38
HTT P42858 1/20 0.38
RET P07949 1/20 0.37

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
SCHEMBL25820138 0.89 TRPV1 (0.45) TRPV1CCNCCDK8MTNR1AMTNR1B
SCHEMBL25820137 0.87 HRH4 (0.48) TRPV1CCNCCDK8MTNR1AMTNR1B
SCHEMBL25820141 0.86 TRPV1 (0.43) SLC2A1TRPV1CCNCCDK8MTNR1A
SCHEMBL25820095 0.77 HTR1A (0.51) TRPV1MTNR1AMTNR1BALDH1A1KDM4E
SCHEMBL25820094 0.77 SLC22A12 (0.42) TRPV1MTNR1AMTNR1B
SCHEMBL25820130 0.76 KDM4E (0.43) TRPV1MTNR1AMTNR1BALDH1A1KDM4E
SCHEMBL25820075 0.76 CCNC (0.42) TRPV1CCNCCDK8
SCHEMBL25820152 0.74 HRH4 (0.46) TRPV1ALDH1A1KDM4ESMN1; SMN2RET
SCHEMBL11159299 0.74 SMYD3 (0.54) SLC2A1ALDH1A1KDM4EMEN1KMT2A
SCHEMBL1644091 0.74 SLC2A1 (0.53) SLC2A1ALDH1A1KDM4EMEN1KMT2A

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-20230219927-A1 AKT3 MODULATORS Georgiamune Inc. 2023-07-13 US disclosed
US-20230183226-A1 AKT3 MODULATORS Georgiamune Inc. 2023-06-15 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-20230183226-A1 AKT3 MODULATORS AKT3, AKT2, MTOR SLC2A1 1031/4885TRPV1 4750/4885CCNC 821/4885
US-20230219927-A1 AKT3 MODULATORS AKT3, AKT2, PIK3CA SLC2A1 799/4885TRPV1 4682/4885CCNC 491/4885

“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.