SCHEMBL26502452

SCHEMBL26502452

Cc1ccc(N2CCC(C(=O)Nc3ccc(C(C)C)cn3)CC2)nn1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TP53 P04637 4/20 0.46
MAPT P10636 3/20 0.46
LMNA P02545 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
KDM4E B2RXH2 4/20 0.45
ALDH1A1 P00352 2/20 0.45
DEGS1 O15121 3/20 0.45
L3MBTL1 Q9Y468 1/20 0.43
RXFP1 Q9HBX9 1/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
GLA P06280 1/20 0.42
PANK3 Q9H999 2/20 0.42

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
SCHEMBL21406020 0.88 PANK3 (0.57) TP53MAPTLMNASMN1; SMN2KDM4E
SCHEMBL26501555 0.85 KMT2A (0.59) TP53MAPTLMNASMN1; SMN2KDM4E
SCHEMBL23750583 0.81 MKNK1 (0.52) DEGS1MEN1KMT2A
SCHEMBL24103799 0.81 DEGS1 (0.58) TP53MAPTALDH1A1DEGS1L3MBTL1
SCHEMBL21424095 0.75 DEGS1 (0.49) DEGS1MEN1KMT2A
SCHEMBL21406433 0.74 PANK3 (0.71) TP53MAPTLMNASMN1; SMN2ALDH1A1
SCHEMBL26702781 0.74 LMNA (0.51) TP53MAPTLMNASMN1; SMN2KDM4E
SCHEMBL16769751 0.74 ACACB (0.49) TP53MAPTLMNASMN1; SMN2KDM4E
SCHEMBL20841045 0.72 LMNA (0.48) TP53MAPTLMNASMN1; SMN2KDM4E
SCHEMBL26502436 0.72 PANK3 (0.44) LMNAALDH1A1PANK3

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-20230321092-A1 METHODS OF TREATING DISORDERS ASSOCIATED WITH CASTOR ST. JUDE CHILDREN'S RESEARCH HOSPITAL, INC. 2023-10-12 US disclosed
US-20230321092-A1 METHODS OF TREATING DISORDERS ASSOCIATED WITH CASTOR ST. JUDE CHILDREN'S RESEARCH HOSPITAL, INC. 2023-10-12 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-20230321092-A1 METHODS OF TREATING DISORDERS ASSOCIATED WITH CASTOR HMGCR, GCDH, CYP11A1 TP53 3054/4885MAPT 1819/4885LMNA 1621/4885

“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.