SCHEMBL8641702

SCHEMBL8641702

Cc1ccc(COc2c(CCCCCc3c(OCc4ccc(C)cc4)c(=O)c3=O)c(=O)c2=O)cc1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ THRA P10827 1/20 0.43
▸ THRB P10828 1/20 0.43
▸ NPC1 O15118 2/20 0.42
▸ HTT P42858 1/20 0.42
▸ MAOB P27338 10/20 0.41
▸ AGXT P21549 2/20 0.40
▸ PARP10 Q53GL7 1/20 0.40
▸ CA1 P00915 1/20 0.39
▸ CA2 P00918 1/20 0.39
▸ CA9 Q16790 1/20 0.39
▸ MAOA P21397 5/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ MAPT P10636 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ ACHE P22303 1/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ RECQL P46063 1/20 0.38
▸ RAB9A P51151 1/20 0.38

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
SCHEMBL8639557 0.84 AGXT (0.50) THRATHRBNPC1HTTMAOB
SCHEMBL8646943 0.72 ALDH1A1 (0.37) THRATHRBALDH1A1MAPT
SCHEMBL13925540 0.67 THRA (0.50) THRATHRBNPC1HTTMAOB
SCHEMBL11698371 0.67 MAOB (0.51) THRATHRBNPC1HTTMAOB
SCHEMBL8645610 0.67 NPC1 (0.54) NPC1MAOBAGXTPARP10MAOA
SCHEMBL19107583 0.67 LTA4H (0.66) CYP1A2CYP2C19
SCHEMBL10571160 0.66 IGF1R (0.61) ALDH1A1ACHECYP1A2
SCHEMBL28184336 0.66 IGF1R (0.61) ALDH1A1ACHECYP1A2
SCHEMBL8930213 0.65 MAOB (0.69) NPC1MAOBAGXTPARP10MAOA
SCHEMBL8929713 0.65 MAOB (0.69) NPC1MAOBAGXTPARP10MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0665789-B1 HEAT-SENSITIVE IMAGE RECORDING MEDIUM AND PROCESS POLAROID CORP (US) 1997-01-22 — — EP claimed
EP-0665789-A1 HEAT-SENSITIVE IMAGE RECORDING MEDIUM AND PROCESS. POLAROID CORP (US) 1995-08-09 — — EP claimed
WO-1994009992-A1 HEAT-SENSITIVE IMAGE RECORDING MEDIUM AND PROCESS POLAROID CORPORATION (US) 1994-05-11 — — WO claimed
EP-0665960-B1 IMAGING MEDIUM AND PROCESS POLAROID CORP (US) 1998-08-19 — — EP disclosed
US-5667943-A SQUARIC ACID DERIVATIVES, LEUCO DYES POLAROID CORPORATION (US) 1997-09-16 — — US disclosed
EP-0665789-B1 HEAT-SENSITIVE IMAGE RECORDING MEDIUM AND PROCESS POLAROID CORP (US) 1997-01-22 — — EP disclosed
US-5578424-A EXPOSING A MIXTURE OF AN ACID PRECURSOR AND A DYE TO ACTINIC RADIATION TO DECOMPOSE PRECURSOR POLAROID CORPORATION (US) 1996-11-26 — — US disclosed
EP-0665961-B1 IMAGING MEDIUM AND PROCESS POLAROID CORP (US) 1996-10-02 — — EP disclosed
US-5534388-A SUPERACID PRECURSOR IS EXPOSED TO ACTINIC RADIATION TO GENERATE SUPERACID; COLORIMETRIC ANALYSIS POLAROID CORPORATION (US) 1996-07-09 — — US disclosed
US-5534393-A SQUARIC ACID DERIVATIVES FOR LEUCO DYES IN IMAGING POLAROID CORPORATION (US) 1996-07-09 — — US disclosed
US-5453345-A Imaging medium POLAROID CORPORATION (US) 1995-09-26 — — US disclosed
US-5445917-A Superacid precursor to catalyze thermal decomposition of secondary acid generator, such as squaric acid and oxalic acid derivatives; effecting color change in imaging process POLAROID CORPORATION (US) 1995-08-29 — — US disclosed
EP-0665789-A1 HEAT-SENSITIVE IMAGE RECORDING MEDIUM AND PROCESS. POLAROID CORP (US) 1995-08-09 — — EP disclosed
US-5401619-A Cyclobut-3-ene-1,2-dione, a dye and a binder POLAROID CORPORATION (US) 1995-03-28 — — US disclosed
US-5395736-A Exposing superoxide precursor to actinic radiation, generating superacid, mixing with oxalic acid diester, heating POLAROID CORPORATION (US) 1995-03-07 — — US disclosed
US-5334489-A Hydroxylating 3,4-disubstituted-cyclobut-3-ene-1,2-dione by heating in presence of acid catalysts which is generated by exposing actinic radiation from superacid precursor POLAROID CORPORATION (US) 1994-08-02 — — US disclosed
WO-1994009992-A1 HEAT-SENSITIVE IMAGE RECORDING MEDIUM AND PROCESS POLAROID CORPORATION (US) 1994-05-11 — — WO disclosed
US-5286612-A Mixture of superacid precursor and dye POLAROID CORPORATION (US) 1994-02-15 — — US disclosed
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