SCHEMBL6498185

SCHEMBL6498185

CCN(CCCNC(=O)Cc1cccs1)Cc1cccc(Oc2ccccc2)c1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.49
ALDH1A1 P00352 2/20 0.49
HSD17B10 Q99714 1/20 0.48
APP P05067 3/20 0.48
HPGD P15428 2/20 0.47
RAB9A P51151 1/20 0.47
GAA P10253 2/20 0.47
KDM4E B2RXH2 1/20 0.47
PKM P14618 1/20 0.47
ACKR3 P25106 2/20 0.46
BCHE P06276 1/20 0.44
FDFT1 P37268 2/20 0.44
LMNA P02545 1/20 0.43
GLA P06280 1/20 0.43
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL6507435 0.94 RAB9A (0.49) TSHRALDH1A1HSD17B10HPGDRAB9A
SCHEMBL6506745 0.90 ATM (0.48) TSHRALDH1A1APPHPGDRAB9A
SCHEMBL6507792 0.85 MTNR1A (0.51) TSHRHSD17B10APPGAAKDM4E
SCHEMBL6505559 0.84 EPHX2 (0.56) TSHRALDH1A1HSD17B10APPRAB9A
SCHEMBL6506029 0.83 LMNA (0.55) TSHRHSD17B10APPGAABCHE
SCHEMBL6501980 0.83 GAA (0.69) TSHRHSD17B10APPHPGDGAA
SCHEMBL6529392 0.83 TSHR (0.48) TSHRHSD17B10APPGAAACKR3
SCHEMBL6499395 0.82 BCHE (0.56) TSHRHSD17B10APPGAABCHE
SCHEMBL6500080 0.80 CCR8 (0.50) APPGAAKDM4EBCHELMNA
SCHEMBL6508701 0.79 KDM4E (0.50) TSHRALDH1A1HSD17B10KDM4EBCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050143372-A1 Compounds, pharmaceutical compositions and methods of use therefor MILLENNIUM PHARMACEUTICALS, INC. 2005-06-30 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-20050143372-A1 Compounds, pharmaceutical compositions and methods of use therefor CCR8, CCL11, CCR5 TSHR 3179/4885ALDH1A1 1071/4885HSD17B10 1726/4885

“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.