SCHEMBL25820175

SCHEMBL25820175

Cc1cc(CC(C)C)c2cc(N3CCOCC3)ccc2n1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.49
ALDH1A1 P00352 3/20 0.49
POLB P06746 2/20 0.49
MEN1 O00255 2/20 0.49
KDM4E B2RXH2 2/20 0.49
TDP1 Q9NUW8 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
NCF1 P14598 1/20 0.48
MAPT P10636 6/20 0.47
MAPK1 P28482 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
TSHR P16473 1/20 0.47
HSD17B10 Q99714 1/20 0.47
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
RXFP1 Q9HBX9 1/20 0.46
TP53 P04637 2/20 0.45
CYP1A2 P05177 2/20 0.45
CYP3A4 P08684 2/20 0.45
CYP2D6 P10635 1/20 0.45

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
SCHEMBL25821152 0.95 NCF1 (0.47) KMT2AALDH1A1POLBMEN1KDM4E
SCHEMBL25820170 0.89 NCF1 (0.44) KMT2AALDH1A1MEN1KDM4ETDP1
SCHEMBL25820102 0.89 NCF1 (0.41) KMT2AALDH1A1MEN1KDM4ETDP1
SCHEMBL25820145 0.84 SYK (0.38) KMT2AALDH1A1POLBMEN1KDM4E
SCHEMBL25820146 0.84 LATS1 (0.37) KMT2AALDH1A1POLBMEN1KDM4E
SCHEMBL25821148 0.82 MAPT (0.34) KMT2AALDH1A1POLBMEN1KDM4E
SCHEMBL25820105 0.81 CLK1 (0.44) KMT2AALDH1A1POLBMEN1KDM4E
SCHEMBL25820144 0.81 NPSR1 (0.48) KMT2AALDH1A1MEN1KDM4ETDP1
SCHEMBL25820157 0.80 TSHR (0.35) TSHRBRD4
SCHEMBL23999557 0.78 KMT2A (0.54) KMT2AALDH1A1POLBMEN1KDM4E

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 KMT2A 3974/4885ALDH1A1 4541/4885POLB 2609/4885
US-20230219927-A1 AKT3 MODULATORS AKT3, AKT2, PIK3CA KMT2A 4131/4885ALDH1A1 3871/4885POLB 2233/4885

“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.