SCHEMBL15828126

SCHEMBL15828126

CCCN(CCC)c1nsc2ccccc12

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.44
KDM4E B2RXH2 2/20 0.44
ALDH1A1 P00352 1/20 0.44
HSD17B10 Q99714 1/20 0.44
MEN1 O00255 1/20 0.41
NPC1 O15118 1/20 0.41
AGTR1 P30556 1/20 0.41
RAB9A P51151 1/20 0.41
KMT2A Q03164 1/20 0.41
EPAS1 Q99814 5/20 0.39
KCNA3 P22001 1/20 0.36
UTS2R Q9UKP6 1/20 0.36
CRHR1 P34998 3/20 0.35
ALOX15 P16050 1/20 0.35
CREBBP Q92793 1/20 0.35
MAPK1 P28482 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35

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
SCHEMBL14672027 0.84 ALDH1A1 (0.46) MAPTKDM4EALDH1A1HSD17B10MEN1
SCHEMBL14672047 0.82 KDM4E (0.44) MAPTKDM4EALDH1A1HSD17B10EPAS1
SCHEMBL15202860 0.81 HTR1A (0.36)
SCHEMBL15505745 0.80 ALDH1A1 (0.43) MAPTKDM4EALDH1A1HSD17B10MEN1
SCHEMBL13591192 0.78 MAPT (0.38) MAPTKDM4EALDH1A1HSD17B10EPAS1
SCHEMBL12125000 0.76 MAPT (0.46) MAPTKDM4EALDH1A1HSD17B10NPC1
SCHEMBL4139724 0.76 CRHR1 (0.40) MAPTKDM4EALDH1A1CRHR1MAPK1
SCHEMBL14672048 0.76 KDM4E (0.36) MAPTKDM4EALDH1A1HSD17B10MEN1
SCHEMBL28202495 0.70 KDM4E (0.47) MAPTKDM4EALDH1A1HSD17B10EPAS1
SCHEMBL12659714 0.70 MAPT (0.41) MAPTKDM4EALDH1A1HSD17B10MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8981095-B2 Intermediate compounds and process for the preparation of lurasidone and salts thereof MAPI PHARMA LTD. (IL) 2015-03-17 US disclosed
US-20140179922-A1 INTERMEDIATE COMPOUNDS AND PROCESS FOR THE PREPARATION OF LURASIDONE AND SALTS THEREOF MAPI PHARMA LTD. (IL) 2014-06-26 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-20140179922-A1 INTERMEDIATE COMPOUNDS AND PROCESS FOR THE PREPARATION OF LURASIDONE AND SALTS THEREOF REN, AVPR1B, AVPR2 MAPT 608/4885KDM4E 3834/4885ALDH1A1 353/4885

“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.