SCHEMBL6809238

SCHEMBL6809238

COC(=O)c1cc(C)ccc1S(=O)(=O)c1ccc(C[C@@H](C)NC(=O)C(F)(F)F)cc1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 6/20 0.46
GAA P10253 1/20 0.40
ACACB O00763 4/20 0.39
ESR1 P03372 1/20 0.38
KCNH2 Q12809 1/20 0.38
CDK1 P06493 1/20 0.37
CA2 P00918 2/20 0.36
ABCC9 O60706 1/20 0.36
ABCC8 Q09428 1/20 0.36
KCNJ11 Q14654 1/20 0.36
KCNJ8 Q15842 1/20 0.36
BMP1 P13497 1/20 0.36
TP53 P04637 1/20 0.35
POLB P06746 1/20 0.35
THRB P10828 1/20 0.35
MEN1 O00255 1/20 0.35
MAPT P10636 1/20 0.35
KMT2A Q03164 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
SCHEMBL6805535 0.85 CNR1 (0.43) CNR1GAAACACBESR1KCNH2
SCHEMBL6677304 0.84 CNR1 (0.54) CNR1ACACBTP53
SCHEMBL6681814 0.83 CNR1 (0.48) CNR1ACACBABCC9ABCC8KCNJ11
SCHEMBL6677333 0.83 CNR1 (0.46) CNR1GAAACACBESR1KCNH2
SCHEMBL6809808 0.83 CNR1 (0.41) CNR1GAAACACBESR1KCNH2
SCHEMBL6676664 0.83 CNR1 (0.41) CNR1GAAACACBESR1KCNH2
SCHEMBL6677359 0.82 CNR1 (0.45) CNR1GAAACACBESR1KCNH2
SCHEMBL6676723 0.82 CA2 (0.43) CNR1GAACDK1CA2BMP1
SCHEMBL6805794 0.82 MAPT (0.42) CNR1GAAACACBESR1KCNH2
SCHEMBL6803630 0.81 CNR1 (0.40) CNR1GAAACACBESR1KCNH2

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-20040106653-A1 Aminoalcohol derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-06-03 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-20040106653-A1 Aminoalcohol derivatives FANCD2, FANCI, HRH2 CNR1 112/4885GAA 3654/4885ACACB 1800/4885

“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.