SCHEMBL6166395

SCHEMBL6166395

Oc1ccc2c(c1Br)CCC2

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL2L1 Q07817 1/20 0.47
BAD Q92934 1/20 0.47
PARP1 P09874 1/20 0.35
GRIA1 P42261 1/20 0.33
GRIA2 P42262 1/20 0.33
GRIA3 P42263 1/20 0.33
GRIA4 P48058 1/20 0.33
POLB P06746 1/20 0.33
NQO1 P15559 1/20 0.32
EP300 Q09472 1/20 0.32
ESR1 P03372 1/20 0.32
ESR2 Q92731 1/20 0.32
ALDH1A1 P00352 1/20 0.31
NOS3 P29474 1/20 0.31
NOS1 P29475 1/20 0.31
NOS2 P35228 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
CES1 P23141 1/20 0.31
XDH P47989 1/20 0.31

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
SCHEMBL630475 0.96 BCL2L1 (0.52) BCL2L1BADGRIA1GRIA2GRIA3
SCHEMBL16239399 0.79 BCL2L1 (0.52) BCL2L1BADPARP1GRIA1GRIA2
SCHEMBL1535927 0.77 BCL2L1 (0.50) BCL2L1BAD
SCHEMBL1284960 0.75 BCL2L1 (0.58) BCL2L1BADPARP1GRIA1GRIA2
SCHEMBL22989664 0.74 PARP1 (0.39) BCL2L1BADPARP1NOS3NOS1
SCHEMBL13091628 0.74 NOS3 (0.39) BCL2L1BADPARP1ALDH1A1NOS3
SCHEMBL22990006 0.74 PNMT (0.43) BCL2L1BADPARP1
SCHEMBL11317199 0.74 BCL2L1 (0.47) BCL2L1BADPARP1GRIA1GRIA2
SCHEMBL30047413 0.74 BCL2L1 (0.47) BCL2L1BADPARP1POLBESR1
SCHEMBL2046938 0.74 BCL2L1 (0.42) BCL2L1BADPARP1GRIA1GRIA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12168653-B2 Sulfonamide derivates as NLRP3 inhibitors INFLAZOME LIMITED (IE) 2024-12-17 US disclosed
US-12030879-B2 Sulfonyl acetamides as NLRP3 inhibitors INFLAZOME LIMITED (IE) 2024-07-09 US disclosed
US-11884645-B2 Sulfonyl acetamides as NLRP3 inhibitors INFLAZOME LIMITED (IE) 2024-01-30 US disclosed
US-11834433-B2 Compounds INFLAZOME LIMITED (IE) 2023-12-05 US disclosed
US-11834433-B2 Compounds INFLAZOME LIMITED (IE) 2023-12-05 US disclosed
US-11834433-B2 Compounds INFLAZOME LIMITED (IE) 2023-12-05 US disclosed
US-11530200-B2 Compounds INFLAZOME LIMITED (IE) 2022-12-20 US disclosed
US-20210047302-A1 NOVEL COMPOUNDS INFLAZOME LIMITED (IE) 2021-02-18 US disclosed
US-20210040065-A1 NOVEL COMPOUNDS INFLAZOME LIMITED (IE) 2021-02-11 US disclosed
US-20210002274-A1 NOVEL COMPOUNDS INFLAZOME LIMITED (IE) 2021-01-07 US disclosed
US-20200407340-A1 SULFONAMIDE DERIVATES AS NLRP3 INHIBITORS INFLAZOME LIMITED (IE) 2020-12-31 US disclosed
US-20200399243-A1 NOVEL COMPOUNDS INFLAZOME LIMITED (IE) 2020-12-24 US disclosed
US-6964965-B2 Substituted pyrazine derivatives PHARMACIA & UPJOHN (US) 2005-11-15 US disclosed
EP-1499599-A1 SUBSTITUTED PYRAZINE DERIVATIVES Pharmacia & Upjohn Company LLC (US) 2005-01-26 EP disclosed
US-20040053941-A1 Substituted pyrazine derivatives PHARMACIA & UPJOHN COMPANY 2004-03-18 US disclosed
WO-2003091225-A1 SUBSTITUTED PYRAZINE DERIVATIVES PHARMACIA & UPJOHN COMPANY (US) 2003-11-06 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 (11 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-20040053941-A1 Substituted pyrazine derivatives CRHR1, CRHR2, CRH BCL2L1 4127/4885BAD 2606/4885PARP1 2688/4885
US-20210047302-A1 NOVEL COMPOUNDS NLRP3, NOD1, CBR3 BCL2L1 1809/4885BAD 649/4885PARP1 516/4885
US-20210040065-A1 NOVEL COMPOUNDS NLRP3, NOD1, NLRP1 BCL2L1 1317/4885BAD 263/4885PARP1 258/4885
US-12030879-B2 Sulfonyl acetamides as NLRP3 inhibitors NLRP3, NOD1, NLRP1 BCL2L1 2485/4885BAD 1563/4885PARP1 1414/4885
US-20200407340-A1 SULFONAMIDE DERIVATES AS NLRP3 INHIBITORS NLRP3, NOD1, NLRP1 BCL2L1 2876/4885BAD 1766/4885PARP1 880/4885
US-20200399243-A1 NOVEL COMPOUNDS NLRP3, NOD1, NLRP1 BCL2L1 1973/4885BAD 800/4885PARP1 477/4885
US-11884645-B2 Sulfonyl acetamides as NLRP3 inhibitors NLRP3, NOD1, ABCC5 BCL2L1 2062/4885BAD 1716/4885PARP1 1619/4885
US-11834433-B2 Compounds NLRP3, NOD1, PYCARD BCL2L1 1499/4885BAD 334/4885PARP1 258/4885
US-20210002274-A1 NOVEL COMPOUNDS NLRP3, NOD1, NLRP1 BCL2L1 2481/4885BAD 988/4885PARP1 659/4885
US-12168653-B2 Sulfonamide derivates as NLRP3 inhibitors NLRP3, NOD1, NLRP1 BCL2L1 2876/4885BAD 1766/4885PARP1 880/4885
US-11530200-B2 Compounds NLRP3, NOD1, NLRP1 BCL2L1 1757/4885BAD 670/4885PARP1 446/4885

“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.