SCHEMBL6540686

SCHEMBL6540686

O=C(NCCc1ccc(S(=O)(=O)Cl)cc1Cl)C(F)(F)F

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 3/20 0.43
MTNR1B P49286 2/20 0.43
TRPV1 Q8NER1 1/20 0.43
CNR1 P21554 1/20 0.41
HPGD P15428 1/20 0.40
PLAAT3 P53816 1/20 0.39
PLAAT5 Q96KN8 1/20 0.39
PLAAT2 Q9NWW9 1/20 0.39
PLAAT4 Q9UL19 1/20 0.39
ALDH1A1 P00352 1/20 0.38
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
CA7 P43166 1/20 0.37
CA9 Q16790 1/20 0.37

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
SCHEMBL6435988 0.82 TRPV1 (0.60) TRPV1CNR1HPGDPLAAT3PLAAT5
SCHEMBL6540614 0.81 MTNR1A (0.54) MTNR1AMTNR1BTRPV1CNR1ALDH1A1
SCHEMBL6554233 0.81 POLB (0.49) MTNR1AMTNR1BTRPV1MEN1KMT2A
SCHEMBL24826413 0.80 KMT2A (0.46) MTNR1AMTNR1BTRPV1CNR1HPGD
SCHEMBL30139260 0.80 KMT2A (0.46) MTNR1AMTNR1BTRPV1CNR1HPGD
SCHEMBL18255073 0.80 TRPV1 (0.48) MTNR1AMTNR1BTRPV1CNR1HPGD
SCHEMBL6541144 0.79 CA1 (0.53) ALDH1A1CA1CA2MEN1KMT2A
SCHEMBL6540852 0.79 ALDH1A1 (0.51) MTNR1AMTNR1BTRPV1ALDH1A1
SCHEMBL6539895 0.79 KMT2A (0.49) MTNR1AMTNR1BHPGDALDH1A1CA1
SCHEMBL6554230 0.78 MTNR1A (0.44) MTNR1AMTNR1BTRPV1

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 MTNR1A 245/4885MTNR1B 464/4885TRPV1 412/4885

“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.