SCHEMBL2157659

SCHEMBL2157659

CC(=O)N(Cc1ccccc1C)c1csc(-c2ccccc2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSPO P30536 2/20 0.43
HCRTR1 O43613 1/20 0.41
KMT2A Q03164 5/20 0.40
MEN1 O00255 4/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ALDH1A1 P00352 5/20 0.38
KDM4E B2RXH2 2/20 0.38
USP2 O75604 1/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
ALOX15 P16050 1/20 0.38
HSD17B10 Q99714 1/20 0.38
LTB4R2 Q9NPC1 1/20 0.36
LMNA P02545 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
RAB9A P51151 2/20 0.35
NPC1 O15118 1/20 0.35
TSHR P16473 1/20 0.35
HSD17B1 P14061 1/20 0.35
HSD17B2 P37059 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
SCHEMBL2157674 0.88 PTGDR2 (0.42) HCRTR1KMT2AMEN1L3MBTL1ALDH1A1
SCHEMBL2157862 0.87 MEN1 (0.45) HCRTR1KMT2AMEN1ALDH1A1MAPT
SCHEMBL6625774 0.85 NPC1 (0.41) HCRTR1KMT2AALDH1A1LMNARAB9A
SCHEMBL2157792 0.81 TSPO (0.54) TSPOKMT2AMEN1L3MBTL1ALDH1A1
SCHEMBL2158006 0.81 RIPK1 (0.41) TSPOKMT2AMEN1L3MBTL1LTB4R2
SCHEMBL2157683 0.78 TSPO (0.47) TSPOKMT2AMEN1L3MBTL1MAPT
SCHEMBL3809716 0.76 KDM4E (0.42) KMT2AMEN1ALDH1A1KDM4EMAPT
SCHEMBL2158539 0.75 ALDH1A1 (0.41) ALDH1A1KDM4EHPGDLTB4R2LMNA
SCHEMBL3809719 0.74 KMT2A (0.39) TSPOKMT2AMEN1ALDH1A1KDM4E
SCHEMBL2157764 0.74 MEN1 (0.44) KMT2AMEN1ALDH1A1LTB4R2TP53

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-7985769-B2 Compounds and methods for the treatment or prevention of Flavivirus infections VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-07-26 US disclosed
US-20060142347-A1 Compounds and methods for the treatment or prevention of Flavivirus infections VERTEX PHARMACEUTICALS (CANADA) INCORPORATED (CA) 2006-06-29 US disclosed
US-6881741-B2 Compounds and methods for the treatment or prevention of Flavivirus infections VIROCHEM PHARMA INC. (CA) 2005-04-19 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-20060142347-A1 Compounds and methods for the treatment or prevention of Flavivirus infections HAVCR2, ZC3HAV1, MAVS TSPO 2027/4885HCRTR1 1634/4885KMT2A 3270/4885

“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.