SCHEMBL6281135

SCHEMBL6281135

CCSc1cc(C)nc(SCC)c1NC(=O)CN1CCN(CCO)CC1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SOAT1 P35610 6/20 0.52
ALOX15 P16050 1/20 0.46
KDM4E B2RXH2 3/20 0.45
ALDH1A1 P00352 4/20 0.44
HSD17B10 Q99714 2/20 0.43
MEN1 O00255 1/20 0.42
POLB P06746 1/20 0.42
KMT2A Q03164 1/20 0.42
RAB9A P51151 1/20 0.41
HPGD P15428 2/20 0.41
LMNA P02545 1/20 0.41
TSHR P16473 1/20 0.40
GFER P55789 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
EGFR P00533 1/20 0.39

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
SCHEMBL4513891 0.85 SOAT1 (0.65) SOAT1ALOX15KDM4EALDH1A1HSD17B10
SCHEMBL6277357 0.82 SOAT1 (0.49) SOAT1ALOX15KDM4EALDH1A1HSD17B10
SCHEMBL6282714 0.80 SOAT1 (0.37) SOAT1
SCHEMBL6280133 0.79 SOAT1 (0.81) SOAT1ALDH1A1POLBRAB9ASMN1; SMN2
SCHEMBL6282168 0.77 SOAT1 (0.81) SOAT1POLBLMNA
SCHEMBL4985802 0.76 RXFP1 (0.40) KDM4EALDH1A1MEN1POLBKMT2A
SCHEMBL6391904 0.76 SOAT1 (0.61) SOAT1ALOX15KDM4EALDH1A1LMNA
SCHEMBL6283739 0.75 SOAT1 (0.60) SOAT1KDM4EALDH1A1
SCHEMBL6279639 0.74 SOAT1 (0.59) SOAT1LMNA
SCHEMBL6627093 0.74 SOAT1 (0.50) SOAT1ALOX15ALDH1A1HSD17B10POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6969711-B2 Cyclic diamine compounds and medicine containing the same KOWA COMPANY, LTD. (JP) 2005-11-29 US disclosed
EP-0987254-B1 NOVEL CYCLIC DIAMINE COMPOUNDS AND MEDICINE CONTAINING THE SAME KOWA CO (JP) 2004-12-22 EP disclosed
US-20040038987-A1 Novel cyclic diamine compounds and medicine containing the same KOWA COMPANY, LTD. (JP) 2004-02-26 US disclosed
EP-0987254-A1 NOVEL CYCLIC DIAMINE COMPOUNDS AND MEDICINE CONTAINING THE SAME Kowa Co., Ltd. (JP) 2000-03-22 EP 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-20040038987-A1 Novel cyclic diamine compounds and medicine containing the same LCAT, ACAT2, ACAT1 SOAT1 5/4885ALOX15 1271/4885KDM4E 1460/4885

“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.