SCHEMBL5862288

SCHEMBL5862288

COc1ccc(S(=O)(=O)c2ccc(C)nc2Cl)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PKM P14618 3/20 0.53
▸ GAA P10253 2/20 0.46
▸ RAPGEF4 Q8WZA2 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.44
▸ CYP3A4 P08684 1/20 0.44
▸ CYP2C9 P11712 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44
▸ RXFP1 Q9HBX9 1/20 0.44
▸ TP53 P04637 2/20 0.43
▸ POLB P06746 2/20 0.43
▸ MAPT P10636 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ HTR6 P50406 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ HPGD P15428 1/20 0.42
▸ CNR2 P34972 2/20 0.42

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
SCHEMBL6744052 0.81 EGFR (0.53) PKMGAAALDH1A1RXFP1MAPT
SCHEMBL6744833 0.80 POLB (0.48) PKMGAAALDH1A1RXFP1TP53
SCHEMBL5860975 0.79 KMT2A (0.53) PKMGAARAPGEF4ALDH1A1RXFP1
SCHEMBL5861275 0.78 HPGD (0.41) GAAKMT2AHTTHPGD
SCHEMBL14485916 0.76 PKM (0.58) PKMGAARAPGEF4ALDH1A1CYP3A4
SCHEMBL14485941 0.74 PKM (0.50) PKMGAARAPGEF4ALDH1A1CYP3A4
SCHEMBL5862275 0.72 RAPGEF4 (0.56) RAPGEF4
SCHEMBL8145743 0.72 PKM (0.62) PKMGAARAPGEF4RXFP1MAPT
SCHEMBL13074716 0.72 PKM (1.00) PKMGAARAPGEF4ALDH1A1POLB
SCHEMBL14486413 0.72 PKM (1.00) PKMGAARAPGEF4ALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7030145-B2 Pyridinyl derivatives for the treatment of depression BRISTOL-MYERS SQUIBB COMPANY (US) 2006-04-18 — — US disclosed
US-20040209917-A1 Pyridinyl derivatives for the treatment of depression HARTZ RICHARD A (US) 2004-10-21 — — 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-20040209917-A1 Pyridinyl derivatives for the treatment of depression CRH, CRHR1, CRHR2 PKM 796/4885GAA 4203/4885RAPGEF4 1558/4885

“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.

Send feedback