SCHEMBL14415422

SCHEMBL14415422

CC(C)CCCC(C)[C@H]1CCC2C3=CC[C@H]4CC(=O)CC[C@]4(C)C3CC[C@@]21C

nearest known ligand 0.68

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.68
▸ KMT2A Q03164 2/20 0.68
▸ USP2 O75604 2/20 0.68
▸ ALDH1A1 P00352 2/20 0.68
▸ MAPT P10636 1/20 0.68
▸ ALOX15 P16050 1/20 0.68
▸ CYP3A4 P08684 1/20 0.63
▸ DHCR24 Q15392 6/20 0.51
▸ CDC25B P30305 2/20 0.46
▸ CDC25A P30304 1/20 0.46
▸ SRD5A1 P18405 6/20 0.45
▸ THRB P10828 1/20 0.43
▸ SRD5A2 P31213 3/20 0.43

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
SCHEMBL12883833 1.00 MEN1 (0.68) MEN1KMT2AUSP2ALDH1A1MAPT
SCHEMBL13077330 1.00 MEN1 (0.68) MEN1KMT2AUSP2ALDH1A1MAPT
SCHEMBL12869820 1.00 MEN1 (0.68) MEN1KMT2AUSP2ALDH1A1MAPT
SCHEMBL7797018 1.00 MEN1 (0.68) MEN1KMT2AUSP2ALDH1A1MAPT
SCHEMBL12884155 1.00 MEN1 (0.68) MEN1KMT2AUSP2ALDH1A1MAPT
SCHEMBL1032902 1.00 MEN1 (0.68) MEN1KMT2AUSP2ALDH1A1MAPT
SCHEMBL12869828 0.91 CYP3A4 (0.60) MEN1KMT2AUSP2ALDH1A1MAPT
SCHEMBL12869769 0.91 CYP3A4 (0.60) MEN1KMT2AUSP2ALDH1A1MAPT
SCHEMBL12869841 0.91 CYP3A4 (0.60) MEN1KMT2AUSP2ALDH1A1MAPT
SCHEMBL12869768 0.91 CYP3A4 (0.60) MEN1KMT2AUSP2ALDH1A1MAPT

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-20070219173-A1 LIGANDS FOR NEMATODE NUCLEAR RECEPTORS AND USES THEREOF BOARD OF REGENTS, UNIVERSITY OF TEXAS SYSTEM 2007-09-20 — — US disclosed
US-20070219173-A1 LIGANDS FOR NEMATODE NUCLEAR RECEPTORS AND USES THEREOF BOARD OF REGENTS, UNIVERSITY OF TEXAS SYSTEM 2007-09-20 — — 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-20070219173-A1 LIGANDS FOR NEMATODE NUCLEAR RECEPTORS AND USES THEREOF NR1H2, NR4A1, NR0B1 MEN1 4512/4885KMT2A 2834/4885USP2 3723/4885

“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.

Send feedback