SCHEMBL3365732

SCHEMBL3365732

CCN1CCCN(c2cncc(Cl)n2)CC1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 3/20 0.54
KDM4E B2RXH2 2/20 0.54
MEN1 O00255 1/20 0.54
ALDH1A1 P00352 1/20 0.54
CYP1A2 P05177 1/20 0.54
CYP3A4 P08684 1/20 0.54
HTR1A P08908 1/20 0.54
CYP2C9 P11712 1/20 0.54
HPGD P15428 1/20 0.54
HTR2C P28335 1/20 0.54
CYP2C19 P33261 1/20 0.54
KMT2A Q03164 1/20 0.54
HSD17B10 Q99714 1/20 0.54
HRH3 Q9Y5N1 1/20 0.42
GAA P10253 1/20 0.39
DRD2 P14416 2/20 0.37
HRH1 P35367 2/20 0.37

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
SCHEMBL10294633 0.94 HTR2A (0.60) HTR2AKDM4EMEN1ALDH1A1CYP1A2
SCHEMBL939716 0.82 ALDH1A1 (0.70) HTR2AKDM4EMEN1ALDH1A1CYP1A2
SCHEMBL2215086 0.81 KDM4E (0.57) HTR2AKDM4EMEN1ALDH1A1CYP1A2
SCHEMBL19673985 0.80 CYP1A2 (0.68) HTR2AKDM4EMEN1ALDH1A1CYP1A2
SCHEMBL31558499 0.80 CYP1A2 (0.68) HTR2AKDM4EMEN1ALDH1A1CYP1A2
SCHEMBL12813911 0.78 HTR2A (0.57) HTR2AKDM4EMEN1ALDH1A1CYP1A2
SCHEMBL3366951 0.78 HTR2A (0.53) HTR2AKDM4EMEN1ALDH1A1CYP1A2
SCHEMBL3056725 0.77 KDM4E (0.64) HTR2AKDM4EMEN1ALDH1A1CYP1A2
SCHEMBL19035675 0.77 HRH3 (0.47) KDM4EHTR1AHRH3DRD2
SCHEMBL11553338 0.76 HTR2A (0.54) HTR2AKDM4EMEN1ALDH1A1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100331315-A1 RHODANINES AND RELATED HETEROCYCLES AS KINASE INHIBITORS SENHWA BIOSCIENCES, INC. (TW) 2010-12-30 US disclosed
US-20100331315-A1 RHODANINES AND RELATED HETEROCYCLES AS KINASE INHIBITORS SENHWA BIOSCIENCES, INC. (TW) 2010-12-30 US disclosed
US-20100331315-A1 RHODANINES AND RELATED HETEROCYCLES AS KINASE INHIBITORS SENHWA BIOSCIENCES, INC. (TW) 2010-12-30 US disclosed
WO-2010148351-A1 RHODANINES AND RELATED HETEROCYCLES AS KINASE INHIBITORS CYLENE PHARMACEUTICALS, INC. (US) 2010-12-23 WO disclosed
WO-2010148351-A1 RHODANINES AND RELATED HETEROCYCLES AS KINASE INHIBITORS CYLENE PHARMACEUTICALS, INC. (US) 2010-12-23 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 (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-20100331315-A1 RHODANINES AND RELATED HETEROCYCLES AS KINASE INHIBITORS PIM2, PIM1, CDK2 HTR2A 3469/4885KDM4E 2503/4885MEN1 2930/4885

“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.