SCHEMBL5856637

SCHEMBL5856637

O=C(CN1CCCC(O)C1)Nc1sc2c(c1C(=O)c1cccs1)CCOC2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 4/20 0.50
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
CNR1 P21554 8/20 0.42
CNR2 P34972 8/20 0.42
ALDH1A1 P00352 3/20 0.42
LMNA P02545 2/20 0.42
TSHR P16473 2/20 0.42
MAPT P10636 1/20 0.42
CASP1 P29466 1/20 0.42
CASP7 P55210 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
ANO1 Q5XXA6 1/20 0.42
KDM4E B2RXH2 1/20 0.41
ALOX15 P16050 1/20 0.41
HSD17B10 Q99714 1/20 0.41
PTPRC P08575 1/20 0.40
PTPN2 P17706 1/20 0.40
PTPN1 P18031 1/20 0.40

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
SCHEMBL5859249 0.89 KIF11 (0.55) KIF11MEN1KMT2ACNR1CNR2
SCHEMBL5858179 0.86 CNR2 (0.43) CNR1CNR2ALDH1A1TSHRMAPT
SCHEMBL5859337 0.86 ANO1 (0.45) KIF11CNR1CNR2ALDH1A1LMNA
SCHEMBL5857629 0.86 ALDH1A1 (0.46) MEN1KMT2AALDH1A1LMNATSHR
SCHEMBL5856399 0.86 KIF11 (0.49) KIF11MEN1KMT2ACNR2ALDH1A1
SCHEMBL5856651 0.85 CNR2 (0.55) MEN1KMT2ACNR1CNR2ALDH1A1
SCHEMBL5856924 0.85 CNR2 (0.44) CNR1CNR2ALDH1A1ANO1KDM4E
SCHEMBL5857663 0.83 CNR2 (0.44) CNR1CNR2LMNA
SCHEMBL8290376 0.78 ALDH1A1 (0.65) KIF11MEN1KMT2AALDH1A1LMNA
SCHEMBL5856947 0.77 MAPT (0.41) KIF11CNR1CNR2ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7071215-B2 Anthelmintic and insecticidal compositions PHARMACIA & UPJOHN COMPANY LLC (US) 2006-07-04 US claimed
EP-1569941-A1 ANTHELMINTIC AND INSECTICIDAL THIOHENE COMPOSITIONS Pharmacia & Upjohn Company LLC (US) 2005-09-07 EP claimed
US-20040127548-A1 Novel anthelmintic and insecticidal compositions LEE BYUNG HYUN (US) 2004-07-01 US claimed
WO-2004035591-A1 ANTHELMINTIC AND INSECTICIDAL THIOHENE COMPOSITIONS PHARMACIA & UPJOHN COMPANY LLC (US) 2004-04-29 WO claimed
US-7071215-B2 Anthelmintic and insecticidal compositions PHARMACIA & UPJOHN COMPANY LLC (US) 2006-07-04 US disclosed
US-20040127548-A1 Novel anthelmintic and insecticidal compositions LEE BYUNG HYUN (US) 2004-07-01 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-20040127548-A1 Novel anthelmintic and insecticidal compositions ACHE, BCHE, AADAC KIF11 2454/4885MEN1 4773/4885KMT2A 3240/4885

“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.