SCHEMBL15329367

SCHEMBL15329367

Cc1cc(-c2ncc3ccccc3n2)cc(C)c1OCCO

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 4/20 0.46
MAPT P10636 3/20 0.42
ALDH1A1 P00352 3/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
ATM Q13315 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
MAOA P21397 3/20 0.36
MAOB P27338 3/20 0.36
GAA P10253 2/20 0.35
PDE10A Q9Y233 1/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 1/20 0.34
KDM4E B2RXH2 2/20 0.34
GLA P06280 1/20 0.34
HPGD P15428 1/20 0.34
HSD17B10 Q99714 1/20 0.34
AR P10275 1/20 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
SCHEMBL15329285 0.79 MEN1 (0.50) NPC1RAB9A
SCHEMBL691154 0.79 KDM4E (0.44) ALDH1A1SMN1; SMN2KDM4E
SCHEMBL18806864 0.75 CYP1A2 (0.61) CYP1A2MAPTALDH1A1SMN1; SMN2MAOA
SCHEMBL30674461 0.75 CYP1A2 (0.58) CYP1A2MAPTALDH1A1SMN1; SMN2MAOA
SCHEMBL28583381 0.75 CYP1A2 (0.58) CYP1A2MAPTALDH1A1SMN1; SMN2MAOA
SCHEMBL28572207 0.75 CYP1A2 (0.57) CYP1A2MAPTSMN1; SMN2MAOAMAOB
SCHEMBL28613677 0.73 CYP1A2 (0.52) CYP1A2MAPTALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL7112190 0.73 ALDH1A1 (0.48) MAPTALDH1A1ATMGAAKDM4E
SCHEMBL347520 0.73 BRD4 (0.47)
SCHEMBL28573822 0.71 CYP1A2 (0.54) CYP1A2MAOAMAOBPDE10ANPC1

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-20160346291-A1 COMPOSITIONS AND THERAPEUTIC METHODS FOR ACCELERATED PLAQUE REGRESSION RESVERLOGIX CORP (CA) 2016-12-01 US disclosed
US-20130281397-A1 TREATMENT OF DISEASES BY EPIGENETIC REGULATION RVX THERAPEUTICS INC. (CA) 2013-10-24 US disclosed
WO-2013156869-A1 TREATMENT OF DISEASES BY EPIGENETIC REGULATION RVX THERAPEUTICS INC. (CA) 2013-10-24 WO 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-20130281397-A1 TREATMENT OF DISEASES BY EPIGENETIC REGULATION BRD4, BMI1, BRPF3 CYP1A2 4781/4885MAPT 2454/4885ALDH1A1 4671/4885
US-20160346291-A1 COMPOSITIONS AND THERAPEUTIC METHODS FOR ACCELERATED PLAQUE REGRESSION PCSK9, TGFB1, HMGCR CYP1A2 4357/4885MAPT 256/4885ALDH1A1 4669/4885

“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.