SCHEMBL6402675

SCHEMBL6402675

CCCCOc1cc(N)[n+]([O-])c(C)n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.38
LMNA P02545 3/20 0.38
MEN1 O00255 2/20 0.38
ALDH1A1 P00352 2/20 0.38
KMT2A Q03164 2/20 0.38
TSHR P16473 2/20 0.38
GLA P06280 1/20 0.38
POLB P06746 1/20 0.38
GAA P10253 1/20 0.38
HPGD P15428 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
TLR8 Q9NR97 3/20 0.36
BCHE P06276 1/20 0.34
ACHE P22303 1/20 0.34
NPC1 O15118 3/20 0.33
RAB9A P51151 3/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
ATM Q13315 1/20 0.33
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL6402618 0.86 TLR8 (0.37) MAPTLMNAMEN1ALDH1A1KMT2A
SCHEMBL6403120 0.85 ALDH1A1 (0.40) MAPTLMNAMEN1ALDH1A1KMT2A
SCHEMBL6401579 0.80 TLR8 (0.40) TSHRTLR8MCHR1CDK1CCNB1
SCHEMBL6403131 0.80 TLR8 (0.40) TSHRTLR8MCHR1CDK1CCNB1
SCHEMBL6397725 0.80 TLR8 (0.40) TSHRTLR8MCHR1CDK1CCNB1
SCHEMBL8689288 0.78 MEN1 (0.38) MAPTLMNAMEN1ALDH1A1KMT2A
SCHEMBL8692203 0.73 MAPT (0.37) MAPTLMNAMEN1ALDH1A1KMT2A
SCHEMBL2990823 0.72 CDK1 (0.46) MAPTLMNAMEN1ALDH1A1KMT2A
SCHEMBL7637855 0.72 MEN1 (0.36) MAPTLMNAMEN1ALDH1A1KMT2A
SCHEMBL2457239 0.71 ALDH1A1 (0.49) MAPTLMNAMEN1ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5438058-A More soluble and less side effects (hypertension) than Minoxidil; treating alopecia, pelade and desquamative dermititis L'OREAL (FR) 1995-08-01 US claimed
EP-0459890-B1 Composition for use in preventing loss of hair and for inducing and stimulating its growth, containing derivatives of 2-alkyl-4-amino(or -2,4-dialkyl)-pyrimidin-3-oxide and the new derivatives of 2-alkyl-4-amino-pyrimidin-3-oxide OREAL (FR) 1994-01-05 EP claimed
US-20050049232-A1 Composition LINDAU PAR (SE) 2005-03-03 US disclosed
EP-1501830-A1 7-ARYL-3,9-DIAZABICYCLO[3.3.1]NON-6-ENE DERIVATIVES AND THEIR USE AS RENIN INHIBITORS IN THE TREATMENT OF HYPERTENSION, CARDIOVASCULAR OR RENAL DISEASES Actelion Pharmaceuticals Ltd. (CH) 2005-02-02 EP disclosed
EP-1463483-A1 NEW COMPOSITION Ponsus Pharma AB (SE) 2004-10-06 EP disclosed
WO-2003093267-A1 7-ARYL-3,9-DIAZABICYCLO(3.3.1)NON-6-ENE DERIVATIVES AND THEIR USE AS RENIN INHIBITORS IN THE TREATMENT OF HYPERTENSION, CARDIOVASCULAR OR RENAL DISEASES ACTELION PHARMACEUTICALS LTD (CH) 2003-11-13 WO disclosed
WO-2003055454-A1 NEW COMPOSITION PONSUS PHARMA AB (SE) 2003-07-10 WO disclosed
US-5438058-A More soluble and less side effects (hypertension) than Minoxidil; treating alopecia, pelade and desquamative dermititis L'OREAL (FR) 1995-08-01 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-20050049232-A1 Composition CUTA, LIPG, LIPA MAPT 3490/4885LMNA 212/4885MEN1 685/4885

“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.