SCHEMBL3853060

SCHEMBL3853060

Cc1ccc(S(=O)(=O)NCC2CCC(C(=O)O)CC2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 1.00
KMT2A Q03164 6/20 1.00
MEN1 O00255 4/20 1.00
CYP2C9 P11712 1/20 1.00
LMNA P02545 1/20 0.67
MAPT P10636 1/20 0.66
L3MBTL1 Q9Y468 1/20 0.63
MAPK1 P28482 2/20 0.60
POLB P06746 1/20 0.60
CYP3A4 P08684 1/20 0.59
CYP2C19 P33261 1/20 0.59
NPY5R Q15761 1/20 0.59
GBA1 P04062 1/20 0.59
ATM Q13315 1/20 0.58
PKM P14618 1/20 0.58
THRB P10828 1/20 0.57

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
SCHEMBL3851236 0.87 GBA1 (0.79) ALDH1A1KMT2AMEN1CYP2C9MAPT
SCHEMBL5205575 0.87 GBA1 (0.79) ALDH1A1KMT2AMEN1CYP2C9MAPT
SCHEMBL5028416 0.83 KMT2A (0.70) ALDH1A1KMT2AMEN1CYP2C9LMNA
SCHEMBL5028418 0.83 KMT2A (0.70) ALDH1A1KMT2AMEN1CYP2C9LMNA
SCHEMBL3851498 0.82 KMT2A (0.86) ALDH1A1KMT2AMEN1CYP2C9LMNA
SCHEMBL14606672 0.81 ALDH1A1 (0.68) ALDH1A1KMT2AMEN1CYP2C9LMNA
SCHEMBL14606617 0.81 ALDH1A1 (0.68) ALDH1A1KMT2AMEN1CYP2C9LMNA
SCHEMBL27917796 0.81 ALDH1A1 (0.68) ALDH1A1KMT2AMEN1CYP2C9LMNA
SCHEMBL7699722 0.81 KMT2A (0.68) ALDH1A1KMT2AMEN1CYP2C9LMNA
SCHEMBL3851560 0.80 MEN1 (0.80) ALDH1A1KMT2AMEN1CYP2C9LMNA

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-7579504-B2 ABCA1 elevating compounds GILEAD SCIENCES, INC. (US) 2009-08-25 US disclosed
US-20070203245-A1 ABCA1 elevating compounds CV THERAPEUTICS, INC. 2007-08-30 US disclosed
WO-2007067817-A1 ABCA1 ELEVATING COMPOUNDS CV THERAPEUTICS, INC. (US) 2007-06-14 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-20070203245-A1 ABCA1 elevating compounds ABCD3, ABCB4, CETP ALDH1A1 1804/4885KMT2A 4193/4885MEN1 4424/4885

“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.