SCHEMBL4906913

SCHEMBL4906913

O=C(CC(=O)C(F)(F)F)c1cccc(Br)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLOD2 O00469 3/20 0.54
PLOD3 O60568 2/20 0.54
PLOD1 Q02809 2/20 0.54
PARP1 P09874 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.47
ALDH1A1 P00352 3/20 0.47
GLA P06280 1/20 0.47
KDM4E B2RXH2 2/20 0.44
GAA P10253 2/20 0.44
POLB P06746 1/20 0.44
MAPT P10636 1/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
TP53 P04637 1/20 0.44
TP53BP1 Q12888 1/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C19 P33261 1/20 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
SCHEMBL30758864 0.84 PARP1 (0.61) PARP1L3MBTL1ALDH1A1GLAKDM4E
SCHEMBL4255460 0.81 PLOD2 (0.55) PLOD2PLOD3PLOD1L3MBTL1ALDH1A1
SCHEMBL1924322 0.81 PLOD2 (0.64) PLOD2PLOD3PLOD1PARP1L3MBTL1
SCHEMBL30415795 0.81 PLOD2 (0.64) PLOD2PLOD3PLOD1PARP1L3MBTL1
SCHEMBL12365899 0.81 PLOD2 (0.51) PLOD2PLOD3PLOD1
SCHEMBL1346272 0.80 CES2 (0.61) PLOD2PLOD3PLOD1ALDH1A1POLB
SCHEMBL1927100 0.80 ERCC5 (0.61) PLOD2PLOD3PLOD1PARP1L3MBTL1
SCHEMBL1924595 0.80 PLOD2 (0.54) PLOD2PLOD3PLOD1PARP1KDM4E
SCHEMBL23217892 0.79 PARP1 (0.52) PARP1L3MBTL1ALDH1A1GLAGAA
SCHEMBL5873149 0.79 MEN1 (0.65) PLOD2PLOD3PLOD1PARP1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025129104-A1 COMPOUNDS, COMPOSITIONS, AND METHODS OF USING THEREOF SIONNA THERAPEUTICS INC. (US) 2025-06-19 WO disclosed
US-20240002374-A1 5-MEMBERED HETEROARYLAMINOSULFONAMIDES FOR TREATING CONDITIONS MEDIATED BY DEFICIENT CFTR ACTIVITY GENZYME CORPORATION 2024-01-04 US disclosed
EP-4058439-A1 5-MEMBERED HETEROARYLAMINOSULFONAMIDES FOR TREATING CONDITIONS MEDIATED BY DEFICIENT CFTR ACTIVITY Genzyme Corporation (US) 2022-09-21 EP disclosed
CN-115003659-A 5-membered heteroaryl amino sulfonamides for the treatment of conditions mediated by a deficiency in CFTR activity 健赞公司 2022-09-02 CN disclosed
WO-2021097057-A1 5-MEMBERED HETEROARYLAMINOSULFONAMIDES FOR TREATING CONDITIONS MEDIATED BY DEFICIENT CFTR ACTIVITY GENZYME CORPORATION (US) 2021-05-20 WO disclosed
US-20080119488-A1 Modulators Of Nuclear Receptors EXELIXIS, INC. (US) 2008-05-22 US disclosed
US-20080119488-A1 Modulators Of Nuclear Receptors EXELIXIS, INC. (US) 2008-05-22 US disclosed
US-20080119488-A1 Modulators Of Nuclear Receptors EXELIXIS, INC. (US) 2008-05-22 US disclosed
EP-1773337-A2 MODULATORS OF NUCLEAR RECEPTORS Exelixis, Inc. (US) 2007-04-18 EP disclosed
WO-2006025979-A9 MODULATORS OF NUCLEAR RECEPTORS EXELIXIS INC (US) 2006-04-20 WO disclosed
WO-2006025979-A2 MODULATORS OF NUCLEAR RECEPTORS EXELIXIS, INC. (US) 2006-03-09 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 (2 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-20080119488-A1 Modulators Of Nuclear Receptors NR1H2, NR0B1, NR1H3 PLOD2 4633/4885PLOD3 3410/4885PLOD1 4786/4885
US-20240002374-A1 5-MEMBERED HETEROARYLAMINOSULFONAMIDES FOR TREATING CONDITIONS MEDIATED BY DEFICIENT CFTR ACTIVITY CFTR, PKD2, PKD1 PLOD2 4496/4885PLOD3 4325/4885PLOD1 4694/4885

“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.