SCHEMBL21180762

SCHEMBL21180762

Cc1cc(C(=O)NC(C)C)n(C)c1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.50
LMNA P02545 1/20 0.39
HPGD P15428 2/20 0.37
ALDH1A1 P00352 2/20 0.37
TP53 P04637 1/20 0.37
MAPK1 P28482 1/20 0.37
AR P10275 2/20 0.36
RECQL P46063 1/20 0.36
ALOX5 P09917 1/20 0.36
KDM4E B2RXH2 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
CHRM4 P08173 1/20 0.35
PHGDH O43175 1/20 0.35

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
SCHEMBL14355673 0.82 MAPT (0.50) MAPTLMNAHPGDALDH1A1TP53
SCHEMBL22808237 0.82 MAPT (0.50) MAPTLMNAHPGDALDH1A1TP53
SCHEMBL21180776 0.79 BAZ2B (0.42) ALDH1A1TP53ARSMN1; SMN2
SCHEMBL20086468 0.77 MAPT (0.45) MAPTLMNAALDH1A1TP53AR
SCHEMBL22808234 0.77 MAPT (0.45) MAPTMAPK1ARRECQLKDM4E
SCHEMBL20086406 0.76 MAPT (0.44) MAPTLMNAALDH1A1RECQLKDM4E
SCHEMBL11199134 0.76 CYP1A2 (0.47) MAPTTP53KDM4E
SCHEMBL13402946 0.73 KDM4E (0.48) HPGDALDH1A1RECQLKDM4E
SCHEMBL20086452 0.73 MAPT (0.46) MAPTHPGDALDH1A1KDM4ESMN1; SMN2
SCHEMBL20086597 0.73 MAPT (0.42) MAPTHPGDALDH1A1TP53MAPK1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10358439-B2 DNA binding agents with a minor groove binding tail BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2019-07-23 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-10358439-B2 DNA binding agents with a minor groove binding tail TOP2B, TOP2A, TOP1 MAPT 2623/4885LMNA 801/4885HPGD 2386/4885

“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.