SCHEMBL5880944

SCHEMBL5880944

Brc1ccc2c(c1)COO2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 3/20 0.43
BLM P54132 2/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
HTT P42858 1/20 0.39
PNMT P11086 2/20 0.34
ASIC3 Q9UHC3 1/20 0.34
APP P05067 2/20 0.33
PBRM1 Q86U86 1/20 0.33
METAP1 P53582 1/20 0.32
TP53 P04637 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
PKM P14618 1/20 0.32
NPR1 P16066 1/20 0.32
TSHR P16473 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CA12 O43570 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32

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
SCHEMBL11816254 0.83 AHR (0.43) AHRBLMLMNAMAPTHTT
SCHEMBL2177890 0.79 LMNA (0.41) AHRBLMLMNAMAPTHTT
SCHEMBL9518303 0.75 BLM (0.46) AHRBLMLMNAMAPTHTT
SCHEMBL1697236 0.74 CYP3A4 (0.43) MAPTCYP3A4CA2GSK3B
SCHEMBL2809969 0.74 GSK3B (0.33) GSK3B
SCHEMBL1383407 0.74 GSK3B (0.31) GSK3B
SCHEMBL7158984 0.74 LMNA (0.50) LMNAMAPTCYP3A4TSHRTDP1
SCHEMBL6833886 0.74 AHR (0.43) AHRMAPTHTTPNMTMETAP1
SCHEMBL11694183 0.74 CA1 (0.40) MAPTCA2ADRA2AADRA2BADRA2C
SCHEMBL17287441 0.74 ADRA2A (0.34) PNMTTDP2ADRA2AADRA2BADRA2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4551680-A2 METHODS OF MANUFACTURE OF R-MDMA Mind Medicine, Inc. (US) 2025-05-14 EP claimed
CN-119998433-A Method for producing R-MDMA 思维医学股份有限公司 2025-05-13 CN claimed
US-20240010628-A1 METHODS OF MANUFACTURE OF R-MDMA Mind Medicine, Inc. (US) 2024-01-11 US claimed
WO-2024011067-A2 METHODS OF MANUFACTURE OF R-MDMA Mind Medicine, Inc. (US) 2024-01-11 WO claimed
EP-4551680-A2 METHODS OF MANUFACTURE OF R-MDMA Mind Medicine, Inc. (US) 2025-05-14 EP disclosed
EP-4551680-A2 METHODS OF MANUFACTURE OF R-MDMA Mind Medicine, Inc. (US) 2025-05-14 EP disclosed
CN-119998433-A Method for producing R-MDMA 思维医学股份有限公司 2025-05-13 CN disclosed
CN-119998433-A Method for producing R-MDMA 思维医学股份有限公司 2025-05-13 CN disclosed
WO-2024011067-A3 METHODS OF MANUFACTURE OF R-MDMA Mind Medicine, Inc. (US) 2024-03-28 WO disclosed
US-20240010628-A1 METHODS OF MANUFACTURE OF R-MDMA Mind Medicine, Inc. (US) 2024-01-11 US disclosed
US-20240010628-A1 METHODS OF MANUFACTURE OF R-MDMA Mind Medicine, Inc. (US) 2024-01-11 US disclosed
WO-2024011067-A2 METHODS OF MANUFACTURE OF R-MDMA Mind Medicine, Inc. (US) 2024-01-11 WO disclosed
US-7105509-B2 Benzodiazepine derivatives as APP modulators MERCK SHARP & DOHME LIMITED (GB) 2006-09-12 US disclosed
US-20040082572-A1 Benzodiazepine derivatives as app modulators MERCK SHARPE & DOHME LIMITED (GB) 2004-04-29 US disclosed
US-20040023958-A1 Inhibitors of hepatitis C virus RNA-dependent RNA polymerase, and compositions and treatments using the same AGOURON PHARMACEUTICALS, INC. 2004-02-05 US disclosed
EP-1294702-A1 BENZODIAZEPINE DERIVATIVES AS APP MODULATORS MERCK SHARP & DOHME LTD. (GB) 2003-03-26 EP disclosed
CN-1085980-C Meta-guanidino, ureido, thioureido or azacyclic aminobenzoic acid derivatives as integrin antagonists SEARLE & CO (US) 2002-06-05 CN disclosed
WO-2001090084-A1 BENZODIAZEPINE DERIVATIVES AS APP MODULATORS MERCK SHARP & DOHME LIMITED (GB) 2001-11-29 WO disclosed
US-4058607-A DIHALOVINYL DIALKYL PHOSPHATE, 1,3-BENZODIOXOLES AIRWICK INDUSTRIES, INC. (US) 1977-11-15 US disclosed
US-3962415-A Insecticide evaporator comprising DDVP with synergized benzodioxole compound as stabilizer AIRWICK INDUSTRIES, INC. (US) 1976-06-08 US 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-20040082572-A1 Benzodiazepine derivatives as app modulators BACE1, PSEN1, APP AHR 1088/4885BLM 4752/4885LMNA 1324/4885
US-20040023958-A1 Inhibitors of hepatitis C virus RNA-dependent RNA polymerase, and compositions and treatments using the same POLRMT, RNGTT, RNASE1 AHR 2766/4885BLM 2021/4885LMNA 3489/4885

“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.