SCHEMBL6541514

SCHEMBL6541514

CCOC(=O)c1ccc(-c2ccc(S(=O)(=O)c3ccc(CCNCc4ccccc4)cc3)cc2Cl)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.53
TP53 P04637 1/20 0.46
MAPT P10636 4/20 0.44
ALDH1A1 P00352 3/20 0.44
NPSR1 Q6W5P4 2/20 0.44
ABL1 P00519 1/20 0.44
MAPK1 P28482 1/20 0.44
RIN1 Q13671 1/20 0.44
ADRB1 P08588 3/20 0.44
ADRB3 P13945 3/20 0.44
NAMPT P43490 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
HTT P42858 1/20 0.43
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
MEN1 O00255 2/20 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
SCHEMBL6540140 0.91 SMN1; SMN2 (0.46) SMN1; SMN2TP53MAPTALDH1A1NPSR1
SCHEMBL6541100 0.88 SMN1; SMN2 (0.68) SMN1; SMN2TP53MAPTALDH1A1NPSR1
SCHEMBL6540593 0.84 SMN1; SMN2 (0.59) SMN1; SMN2TP53MAPTALDH1A1NPSR1
SCHEMBL6540180 0.83 SMN1; SMN2 (0.55) SMN1; SMN2TP53MAPTALDH1A1NPSR1
SCHEMBL6540975 0.83 MAPT (0.44) SMN1; SMN2TP53MAPTALDH1A1CYP1A2
Hydrochloric Acid SCHEMBL6540354 0.82 ADRB3 (0.65) ADRB1ADRB3
SCHEMBL6679601 0.82 CA2 (0.48) SMN1; SMN2MAPTALDH1A1NPSR1ABL1
SCHEMBL6541404 0.82 SMN1; SMN2 (0.65) SMN1; SMN2TP53MAPTALDH1A1NPSR1
SCHEMBL6680443 0.81 SMN1; SMN2 (0.54) SMN1; SMN2MAPTALDH1A1NPSR1ABL1
SCHEMBL6539474 0.81 SMN1; SMN2 (0.52) SMN1; SMN2TP53MAPTALDH1A1NPSR1

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-20040138462-A1 Aminoalcohol derivatives ASTELLAS PHARMA INC. (JP) 2004-07-15 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-20040138462-A1 Aminoalcohol derivatives BPHL, FANCD2, HRH2 SMN1; SMN2 2146/4885TP53 3788/4885MAPT 4502/4885

“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.