SCHEMBL25826713

SCHEMBL25826713

Cc1cc(OC(C)C)c2cc(N3CCC3)ccc2n1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NCF1 P14598 1/20 0.41
POLB P06746 2/20 0.40
MAPT P10636 2/20 0.40
KMT2A Q03164 2/20 0.40
DNMT1 P26358 1/20 0.40
RAD52 P43351 1/20 0.40
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
HPGD P15428 1/20 0.40
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HSD17B10 Q99714 1/20 0.39
ADRA2A P08913 1/20 0.39
ADRA2B P18089 1/20 0.39
ADRA2C P18825 1/20 0.39
TERT O14746 1/20 0.38

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
SCHEMBL25826714 0.97 NCF1 (0.44) NCF1POLBMAPTKMT2AKDM4E
SCHEMBL25826715 0.89 MAPT (0.52) NCF1POLBMAPTKMT2AKDM4E
SCHEMBL24009992 0.85 ALDH1A1 (0.50) NCF1POLBMAPTKMT2ADNMT1
SCHEMBL24003938 0.84 IP6K1 (0.43) NCF1POLBMAPTKMT2AKDM4E
SCHEMBL25824152 0.82 ALDH1A1 (0.54) NCF1POLBMAPTKMT2AKDM4E
SCHEMBL23999691 0.81 IP6K1 (0.46) NCF1POLBMAPTKMT2AKDM4E
SCHEMBL25826718 0.80 IP6K1 (0.45) KMT2AMEN1ALDH1A1
SCHEMBL25826717 0.77 IP6K1 (0.48) KMT2AMEN1ALDH1A1TERT
SCHEMBL24010770 0.77 TERT (0.50) POLBMAPTKMT2ADNMT1RAD52
SCHEMBL25820102 0.76 NCF1 (0.41) NCF1MAPTKMT2AKDM4EMEN1

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-20230183226-A1 AKT3 MODULATORS Georgiamune Inc. 2023-06-15 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 (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-20230183226-A1 AKT3 MODULATORS AKT3, AKT2, MTOR NCF1 1223/4885POLB 2609/4885MAPT 3999/4885

“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.