SCHEMBL23775433

SCHEMBL23775433

Cc1cc(CN2CCN(CCN)CC2)no1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.43
RECQL P46063 1/20 0.43
AURKA O14965 12/20 0.42
KCNH2 Q12809 3/20 0.42
AURKB Q96GD4 1/20 0.42
AURKC Q9UQB9 1/20 0.42
ALOX15 P16050 1/20 0.42
FLT3 P36888 3/20 0.40
ALDH1A1 P00352 2/20 0.40
KDM4E B2RXH2 1/20 0.40

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
SCHEMBL13559779 0.85 AURKA (0.53) MAPTRECQLAURKAKCNH2AURKB
SCHEMBL20328913 0.81 EGFR (0.52) MAPTRECQLAURKAKCNH2AURKB
SCHEMBL20353495 0.80 MAPT (0.45) MAPTRECQLAURKAKCNH2AURKB
SCHEMBL18932537 0.80 KDM4E (0.48) MAPTRECQLAURKAKCNH2AURKB
SCHEMBL2004023 0.78 MAPT (0.46) MAPTRECQLAURKAKCNH2AURKB
SCHEMBL18705077 0.77 MAPT (0.43) MAPTRECQLAURKAKCNH2AURKB
SCHEMBL20325477 0.77 AURKA (0.45) MAPTRECQLAURKAKCNH2AURKB
SCHEMBL1087788 0.77 AURKA (0.51) MAPTRECQLAURKAKCNH2AURKB
SCHEMBL23775544 0.76 DRD2 (0.43) KCNH2ALOX15ALDH1A1
SCHEMBL14375262 0.75 KDM4E (0.51) MAPTRECQLALDH1A1KDM4E

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-11236122-B2 Triterpene amine derivatives DFH THERAPEUTICS (US) 2022-02-01 US disclosed
US-20210253627-A1 TRITERPENE AMINE DERIVATIVES THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES 2021-08-19 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-20210253627-A1 TRITERPENE AMINE DERIVATIVES BET1, PGGT1B, NFATC1 MAPT 1598/4885RECQL 3398/4885AURKA 2043/4885
US-11236122-B2 Triterpene amine derivatives BET1, PGGT1B, NFATC1 MAPT 1598/4885RECQL 3398/4885AURKA 2043/4885

“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.