SCHEMBL24049581

SCHEMBL24049581

O=C1C=Cc2cccc3ccc(-c4cc(-c5ccccc5)c(-c5ccc6cccc7c6c5C(=O)C=C7)cc4-c4ccccc4)c1c23

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.38
LMNA P02545 4/20 0.38
HPGD P15428 3/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
HIF1A Q16665 3/20 0.38
TP53 P04637 2/20 0.38
MAPK1 P28482 2/20 0.38
CYP1A2 P05177 2/20 0.38
CYP2D6 P10635 2/20 0.38
CYP2C9 P11712 2/20 0.38
CYP2C19 P33261 2/20 0.38
USP2 O75604 1/20 0.38
ALOX12 P18054 1/20 0.38
CDC25A P30304 4/20 0.36
CDC25C P30307 4/20 0.36
ARSA P15289 1/20 0.36
CES1 P23141 3/20 0.36
MAPT P10636 3/20 0.34
KDM4E B2RXH2 2/20 0.34

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
SCHEMBL30477087 1.00 ALDH1A1 (0.38) ALDH1A1LMNAHPGDMEN1KMT2A
SCHEMBL25239102 0.91 LMNA (0.41) ALDH1A1LMNAHPGDMEN1KMT2A
SCHEMBL24049724 0.78 ABCG2 (0.36) ALDH1A1LMNAHPGDMEN1KMT2A
SCHEMBL28928983 0.75 HDAC4 (0.41) ALDH1A1MEN1KMT2AMAPK1CYP1A2
SCHEMBL25742897 0.73 ABCG2 (0.33) ALDH1A1LMNAHPGDMEN1KMT2A
SCHEMBL28929254 0.72 ADORA3 (0.44) ALDH1A1HPGDMEN1KMT2ATP53
SCHEMBL5033199 0.72 ALDH1A1 (0.36) ALDH1A1LMNAHPGDMEN1KMT2A
SCHEMBL295788 0.71 LMNA (0.37) ALDH1A1LMNAHPGDMEN1KMT2A
SCHEMBL24049749 0.70 CYP11B1 (0.40) ALDH1A1LMNAHPGDMEN1KMT2A
SCHEMBL30477088 0.70 CYP11B1 (0.40) ALDH1A1LMNAHPGDMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11685743-B2 Open-shell pi-conjugated molecules exhibiting multidimensional intermolecular covalency, compositions and process for preparing LEHIGH UNIVERSITY 2023-06-27 US disclosed
US-11685743-B2 Open-shell pi-conjugated molecules exhibiting multidimensional intermolecular covalency, compositions and process for preparing LEHIGH UNIVERSITY 2023-06-27 US disclosed
US-20210363153-A1 OPEN-SHELL PI-CONJUGATED MOLECULES EXHIBITING MULTIDIMENSIONAL INTERMOLECULAR COVALENCY, COMPOSITIONS AND PROCESS FOR PREPARING LEHIGH UNIVERSITY 2021-11-25 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-11685743-B2 Open-shell pi-conjugated molecules exhibiting multidimensional intermolecular covalency, compositions and process for preparing INTS6, INTS9, NCLN ALDH1A1 4345/4885LMNA 2131/4885HPGD 3662/4885
US-20210363153-A1 OPEN-SHELL PI-CONJUGATED MOLECULES EXHIBITING MULTIDIMENSIONAL INTERMOLECULAR COVALENCY, COMPOSITIONS AND PROCESS FOR PREPARING INTS6, INTS9, NCLN ALDH1A1 4345/4885LMNA 2131/4885HPGD 3662/4885

“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.