SCHEMBL6541568

SCHEMBL6541568

CCOC(=O)c1cccc(-c2ccc(S(=O)(=O)c3ccc(CCN)cc3)cc2Cl)c1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.45
LMNA P02545 1/20 0.41
HTR6 P50406 2/20 0.41
BCL2L1 Q07817 1/20 0.41
MCL1 Q07820 1/20 0.41
CYP4F2 P78329 1/20 0.40
CYP4A11 Q02928 1/20 0.40
FFAR1 O14842 1/20 0.40
MAPT P10636 1/20 0.39
TP53 P04637 1/20 0.39
POLB P06746 1/20 0.39
HPGD P15428 1/20 0.39
ALDH1A1 P00352 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
SCHEMBL6540975 0.89 MAPT (0.44) CA2LMNAHTR6MAPTTP53
SCHEMBL6540140 0.85 SMN1; SMN2 (0.46) CA2LMNABCL2L1MCL1FFAR1
SCHEMBL6541364 0.80 HTR6 (0.46) CA2LMNAHTR6CYP4F2CYP4A11
Hydrochloric Acid SCHEMBL6540992 0.79 ADRB3 (0.57)
SCHEMBL6809919 0.79 ACACB (0.45) CA2LMNABCL2L1MCL1
SCHEMBL6540404 0.76 TP53 (0.41) BCL2L1MCL1MAPTTP53POLB
SCHEMBL6679601 0.75 CA2 (0.48) CA2CYP4F2CYP4A11MAPTALDH1A1
SCHEMBL6540876 0.75 CA12 (0.41) CA2BCL2L1MCL1MAPTALDH1A1
SCHEMBL6541514 0.75 SMN1; SMN2 (0.53) CA2LMNAMAPTTP53POLB
SCHEMBL6809995 0.74 CA2 (0.49) CA2TP53POLBHPGDALDH1A1

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-20040138462-A1 Aminoalcohol derivatives ASTELLAS PHARMA INC. (JP) 2004-07-15 US disclosed
EP-1389185-A2 AMINOALCOHOL DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-02-18 EP disclosed
WO-2002094770-A2 AMINOALCOHOL DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-11-28 WO 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-20040138462-A1 Aminoalcohol derivatives BPHL, FANCD2, HRH2 CA2 2242/4885LMNA 3736/4885HTR6 522/4885

“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.