SCHEMBL4644027

SCHEMBL4644027

COc1ccc(Cl)c(OC(C)=O)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.56
KDM4E B2RXH2 2/20 0.49
NPC1 O15118 1/20 0.47
ALDH1A1 P00352 3/20 0.46
HPGD P15428 3/20 0.46
F2 P00734 1/20 0.46
GLA P06280 1/20 0.46
POLB P06746 1/20 0.46
MAPT P10636 5/20 0.46
KMT2A Q03164 3/20 0.46
TUBB4A P04350 1/20 0.45
TUBB P07437 1/20 0.45
TUBA3C P0DPH7 1/20 0.45
TUBA1B P68363 1/20 0.45
TUBA4A P68366 1/20 0.45
TUBB4B P68371 1/20 0.45
TUBB3 Q13509 1/20 0.45
TUBB2A Q13885 1/20 0.45
TUBB8 Q3ZCM7 1/20 0.45
TUBA3E Q6PEY2 1/20 0.45

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
SCHEMBL29001439 0.89 KDM4E (0.61) BACE1KDM4ENPC1GLAPOLB
SCHEMBL27452735 0.86 KDM4E (0.53) BACE1KDM4ENPC1ALDH1A1MAPT
SCHEMBL12950694 0.86 BACE1 (0.56) BACE1KDM4EALDH1A1HPGDF2
SCHEMBL4644023 0.84 ALDH1A1 (0.43) NPC1ALDH1A1HPGDPOLBMAPT
SCHEMBL11793587 0.83 BACE1 (0.61) BACE1KDM4ENPC1ALDH1A1HPGD
SCHEMBL3328971 0.81 TSHR (0.64) BACE1KDM4ENPC1ALDH1A1MAPT
SCHEMBL3327344 0.81 CA12 (0.63) BACE1KDM4ENPC1ALDH1A1MAPT
SCHEMBL4644293 0.81 ALDH1A1 (0.45) KDM4ENPC1ALDH1A1HPGDPOLB
SCHEMBL4642607 0.81 MTNR1A (0.48) NPC1ALDH1A1MAPTKMT2ATUBB4A
SCHEMBL4642055 0.81 TDP1 (0.44) BACE1NPC1ALDH1A1POLBTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114984003-B Aromatic sulfonamide derivatives 拜耳制药股份公司 2024-08-27 CN disclosed
CN-115054600-B Aromatic sulfonamide derivatives 拜耳制药股份公司 2024-06-14 CN disclosed
CN-115054600-A Aromatic sulfonamide derivatives 拜耳制药股份公司 2022-09-16 CN disclosed
CN-114984003-A Aromatic sulfonamide derivatives 拜耳制药股份公司 2022-09-02 CN disclosed
CN-109415321-B Aromatic sulfonamide derivatives 拜耳制药股份公司 2022-06-17 CN disclosed
CN-109415321-A aromatic sulfonamide derivatives 拜耳制药股份公司 2019-03-01 CN disclosed
EP-1487928-B1 FILM-FORMING POLYMER AND ANTIFOULING PAINT JOTUN AS (NO) 2008-08-13 EP disclosed
EP-1487928-A1 FILM-FORMING POLYMER AND ANTIFOULING PAINT Jotun AS (NO) 2004-12-22 EP disclosed
WO-2003080747-A1 FILM-FORMING POLYMER AND ANTIFOULING PAINT JOTUN AS (NO) 2003-10-02 WO disclosed