SCHEMBL6139831

SCHEMBL6139831

CC(C)c1ccc(CN2CCN(c3ccccc3)CC2)c(=O)c(OCc2ccccc2)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 7/20 0.56
ALDH1A1 P00352 5/20 0.56
TSHR P16473 2/20 0.56
TP53 P04637 2/20 0.54
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
CA12 O43570 1/20 0.46
CA9 Q16790 1/20 0.46
RECQL P46063 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
MAPT P10636 5/20 0.45
ALOX15 P16050 2/20 0.44
DRD4 P21917 1/20 0.44
TACR1 P25103 2/20 0.42
HPGD P15428 1/20 0.41
DRD2 P14416 1/20 0.40
DRD3 P35462 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
MAPK1 P28482 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
SCHEMBL7924072 0.94 LMNA (0.50) LMNAALDH1A1TSHRTP53MEN1
SCHEMBL7915276 0.93 LMNA (0.53) LMNAALDH1A1TSHRTP53MEN1
SCHEMBL7921093 0.92 LMNA (0.48) LMNAALDH1A1TSHRTP53MEN1
SCHEMBL7923524 0.92 LMNA (0.48) LMNAALDH1A1TSHRTP53MEN1
SCHEMBL7921974 0.92 CA12 (0.56) LMNAALDH1A1TSHRTP53MEN1
SCHEMBL7927261 0.92 LMNA (0.48) LMNAALDH1A1TSHRTP53MEN1
SCHEMBL7927130 0.91 MEN1 (0.54) LMNAALDH1A1TSHRTP53MEN1
SCHEMBL7923530 0.90 CA12 (0.48) LMNAALDH1A1TSHRTP53MEN1
SCHEMBL7921573 0.89 LMNA (0.58) LMNAALDH1A1TSHRTP53MEN1
SCHEMBL7921648 0.88 DRD4 (0.54) LMNATSHRMAPTALOX15DRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050130982-A1 Oral therapeutic or preventative drugs for pollakiuria and urinary incontinence and oral sleep inducers, containing tropolone derivatives NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2005-06-16 US disclosed
EP-1504759-A1 ORAL THERAPEUTIC OR PREVENTIVE DRUGS FOR POLLAKIURIA AND URINARY INCONTINENCE OR ORAL SLEEP INDUCERS, CONTAINING TROPOLONE DERIVATIVES Nippon Kayaku Kabushiki Kaisha (JP) 2005-02-09 EP disclosed
US-6221868-B1 Remedies/preventives for frequent urination/urinary incontinence and tropone derivatives NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2001-04-24 US disclosed
EP-0995741-A1 REMEDIES/PREVENTIVES FOR FREQUENT URINATION/URINARY INCONTINENCE AND TROPONE DERIVATIVES Nippon Kayaku Kabushiki Kaisha (JP) 2000-04-26 EP 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-20050130982-A1 Oral therapeutic or preventative drugs for pollakiuria and urinary incontinence and oral sleep inducers, containing tropolone derivatives MTNR1A, SULT2A1, MTNR1B LMNA 2399/4885ALDH1A1 309/4885TSHR 2978/4885

“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.