SCHEMBL25820234

SCHEMBL25820234

Cc1cc(CC(C)C)c2c(n1)CCC(N1CCC1)C2

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34
HTR2B P41595 1/20 0.34
KDM4E B2RXH2 1/20 0.32
ADAM17 P78536 4/20 0.31
HTR1D P28221 2/20 0.30

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
SCHEMBL25821294 0.90 KMT2A (0.33) HTR2AHTR2CHTR2BKDM4E
SCHEMBL25461128 0.86 ADAM17 (0.34) KDM4EADAM17HTR1D
SCHEMBL25821292 0.84 TLR9 (0.38)
SCHEMBL25821293 0.84 HTR2A (0.33) HTR2AHTR2CHTR2B
SCHEMBL25822499 0.80 ADAM17 (0.31) ADAM17
SCHEMBL25820210 0.79 HTR2A (0.49) HTR2AHTR2CHTR2BHTR1D
SCHEMBL25820235 0.78 IKBKB (0.32)
SCHEMBL25824307 0.77 KDM4E (0.33) HTR2AHTR2CHTR2BKDM4EHTR1D
SCHEMBL23999682 0.76 EHMT2 (0.32) KDM4EHTR1D
SCHEMBL24010035 0.76 EHMT2 (0.41)

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 HTR2A 2819/4885HTR2C 2539/4885HTR2B 3066/4885
US-20230219927-A1 AKT3 MODULATORS AKT3, AKT2, PIK3CA HTR2A 2539/4885HTR2C 2111/4885HTR2B 2588/4885

“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.