SCHEMBL1311028

SCHEMBL1311028

COC(=O)c1ccc(CCl)s1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 2/20 0.54
NPSR1 Q6W5P4 2/20 0.51
LMNA P02545 2/20 0.51
PPARG P37231 1/20 0.51
NCOA2 Q15596 1/20 0.51
NCOA1 Q15788 1/20 0.51
NCOA3 Q9Y6Q9 1/20 0.51
HPGD P15428 4/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
TSHR P16473 1/20 0.50
MAPK1 P28482 1/20 0.50
ATM Q13315 1/20 0.50
MAPT P10636 4/20 0.45
ALDH1A1 P00352 2/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
HTT P42858 2/20 0.45
PARP1 P09874 1/20 0.45
TP53 P04637 1/20 0.43
TDP1 Q9NUW8 2/20 0.41

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
SCHEMBL11984343 0.83 HPGD (0.56) MRGPRX4NPSR1LMNAPPARGNCOA2
SCHEMBL1401544 0.83 LMNA (0.53) MRGPRX4NPSR1LMNAPPARGNCOA2
SCHEMBL8247469 0.82 MRGPRX4 (0.51) MRGPRX4NPSR1LMNAPPARGNCOA2
SCHEMBL6814615 0.82 HDAC3 (0.55) NPSR1HPGDL3MBTL1TSHRMAPK1
SCHEMBL1977403 0.81 NPSR1 (0.51) MRGPRX4NPSR1LMNAPPARGNCOA2
SCHEMBL28857673 0.81 LMNA (0.51) MRGPRX4NPSR1LMNAPPARGNCOA2
SCHEMBL14114132 0.81 LMNA (0.51) MRGPRX4NPSR1LMNAPPARGNCOA2
SCHEMBL348559 0.81 LMNA (0.51) MRGPRX4NPSR1LMNAPPARGNCOA2
SCHEMBL14135378 0.81 LMNA (0.51) MRGPRX4NPSR1LMNAPPARGNCOA2
SCHEMBL16812822 0.81 MRGPRX4 (0.57) MRGPRX4NPSR1LMNAPPARGNCOA2

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 110 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4204808-A1 TARGET ENGAGEMENT ASSAY FOR RAS PROTEINS Promega Corporation (US) 2023-07-05 EP disclosed
CN-116391129-A Target binding assays for RAS proteins 普罗美加公司 2023-07-04 CN disclosed
US-11649222-B2 Compounds UNIVERSITETET I OSLO (NO) 2023-05-16 US disclosed
US-11649222-B2 Compounds UNIVERSITETET I OSLO (NO) 2023-05-16 US disclosed
US-11649222-B2 Compounds UNIVERSITETET I OSLO (NO) 2023-05-16 US disclosed
CN-115160269-A Arylcarboxamide derivatives as positive allosteric modulators of NMDAR 北京大学 2022-10-11 CN disclosed
EP-3440073-B1 KINASE INHIBITORS OXULAR ACQUISITIONS LTD (GB) 2022-06-08 EP disclosed
EP-3978488-A1 ZINC CHELATING COMPOUNDS FOR USE IN THE TREATMENT OF BACTERIAL INFECTION Universitetet I Oslo (NO) 2022-04-06 EP disclosed
EP-3978488-A1 ZINC CHELATING COMPOUNDS FOR USE IN THE TREATMENT OF BACTERIAL INFECTION Universitetet I Oslo (NO) 2022-04-06 EP disclosed
US-20220064696-A1 TARGET ENGAGEMENT ASSAY FOR RAS PROTEINS PROMEGA CORPORATION (US) 2022-03-03 US disclosed
US-20070265321-A1 THERAPEUTIC COMPOUNDS ALLERGAN, INC. 2007-11-15 US disclosed
US-20070265321-A1 THERAPEUTIC COMPOUNDS ALLERGAN, INC. 2007-11-15 US disclosed
US-20070265321-A1 THERAPEUTIC COMPOUNDS ALLERGAN, INC. 2007-11-15 US disclosed
US-20070265330-A1 SUBSTITUTED GAMMA LACTAMS AS THERAPEUTIC AGENTS OLD DAVID W 2007-11-15 US disclosed
CN-101068803-A Biaryloxymethylarene carboxylic acid compounds HOFFMANN LA ROCHE (CH) 2007-11-07 CN disclosed
US-20070203222-A1 SUBSTITUTED GAMMA LACTAMS AS THERAPEUTIC AGENTS ALLERGAN, INC. 2007-08-30 US disclosed
US-20070203222-A1 SUBSTITUTED GAMMA LACTAMS AS THERAPEUTIC AGENTS ALLERGAN, INC. 2007-08-30 US disclosed
WO-2006098918-A2 SUBSTITUTED GAMMA LACTAMS AS THERAPEUTIC AGENTS ALLERGAN, INC. (US) 2006-09-21 WO disclosed
CN-1812956-A Biaryloxymethylarenecarboxylic acids as glycogen synthase activator HOFFMANN LA ROCHE (CH) 2006-08-02 CN disclosed
WO-2004037808-A1 2 - SUBSTITUTED HETEROCYCLIC COMPOUNDS AND ANTITUMOR COMPOSITION COMPRISING THE SAME CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2004-05-06 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 (4 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-20070203222-A1 SUBSTITUTED GAMMA LACTAMS AS THERAPEUTIC AGENTS GLA, GANAB, GGH MRGPRX4 3386/4885NPSR1 4242/4885LMNA 2995/4885
US-11649222-B2 Compounds SLC30A6, SLC39A11, SLC39A3 MRGPRX4 3689/4885NPSR1 617/4885LMNA 1307/4885
US-20070265321-A1 THERAPEUTIC COMPOUNDS ACER2, SLC10A1, ASAH2 MRGPRX4 589/4885NPSR1 1312/4885LMNA 2284/4885
US-20070265330-A1 SUBSTITUTED GAMMA LACTAMS AS THERAPEUTIC AGENTS GLA, GUSB, GANAB MRGPRX4 2399/4885NPSR1 3279/4885LMNA 2349/4885

“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.