SCHEMBL3563780

SCHEMBL3563780

CC(=O)n1c(-c2ccccc2)c(OCCN(C)C)c2ccc(Cl)cc21

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.45
GAA P10253 1/20 0.42
MAPK1 P28482 1/20 0.42
ALDH1A1 P00352 6/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
SIGMAR1 Q99720 1/20 0.40
SLC6A9 P48067 2/20 0.39
HTR6 P50406 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
MAT2A P31153 1/20 0.38
TACR3 P29371 1/20 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
SCHEMBL3555919 0.92 KDM4E (0.45) KDM4EGAAMAPK1ALDH1A1SMN1; SMN2
SCHEMBL6821037 0.90 ABCB1 (0.43) KDM4EGAAMAPK1ALDH1A1SMN1; SMN2
SCHEMBL3565673 0.87 ALDH1A1 (0.45) KDM4EALDH1A1SMN1; SMN2SIGMAR1MEN1
SCHEMBL3560116 0.83 KDM4E (0.43) KDM4EGAAMAPK1ALDH1A1SMN1; SMN2
SCHEMBL3556742 0.83 KDM4E (0.43) KDM4EGAAMAPK1ALDH1A1SMN1; SMN2
SCHEMBL14953594 0.81 KDM4E (0.41) KDM4EGAAMAPK1ALDH1A1SMN1; SMN2
SCHEMBL6919614 0.81 PTGS2 (0.46) KDM4EGAAMAPK1ALDH1A1SMN1; SMN2
SCHEMBL14953558 0.81 HTR6 (0.46) KDM4ESIGMAR1HTR6MAT2A
SCHEMBL3561464 0.81 ALDH1A1 (0.45) KDM4EALDH1A1SMN1; SMN2SIGMAR1MEN1
SCHEMBL6817304 0.81 ESR1 (0.43) KDM4EHTR6

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
EP-1567492-B1 N-ARYLSULFONYL-3-AMINOALKOXYINDOLES SUVEN LIFE SCIENCES LTD (IN) 2013-05-22 EP disclosed
US-7718690-B2 N-arylsulfonyl-3-aminoalkoxyindoles RAMAKRISHNA VENKATA SATYA NIROGI 2010-05-18 US disclosed
US-20090131507-A1 N-arylsulfonyl-3-aminoalkoxyindoles SUVEN LIFE SCIENCES LIMITED (IN) 2009-05-21 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-20090131507-A1 N-arylsulfonyl-3-aminoalkoxyindoles HTR3C, HTR3A, AANAT KDM4E 3751/4885GAA 4482/4885MAPK1 2581/4885

“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.