SCHEMBL246938

SCHEMBL246938

O=C(OC(=O)c1ccc(Br)cc1)c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.62
RAB9A P51151 3/20 0.62
HPGD P15428 2/20 0.62
MAPT P10636 3/20 0.61
SMN1; SMN2 Q16637 2/20 0.61
F2 P00734 1/20 0.54
LMNA P02545 1/20 0.54
CES2 O00748 2/20 0.50
CES1 P23141 2/20 0.50
TSHR P16473 1/20 0.50
AKR1C3 P42330 1/20 0.50
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
TP53 P04637 1/20 0.49
KDM4E B2RXH2 1/20 0.47
ALDH1A1 P00352 1/20 0.47
CYP1B1 Q16678 1/20 0.47
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CYP1A2 P05177 1/20 0.46

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
SCHEMBL246937 0.91 CES2 (0.59) NPC1RAB9AHPGDMAPTSMN1; SMN2
SCHEMBL8717537 0.89 LMNA (0.67) MAPTSMN1; SMN2F2LMNACES2
SCHEMBL10802301 0.87 F2 (0.74) NPC1RAB9AHPGDMAPTSMN1; SMN2
Benzene SCHEMBL27793442 0.86 LMNA (0.70) MAPTSMN1; SMN2F2LMNACES2
SCHEMBL52413 0.86 LMNA (0.70) MAPTSMN1; SMN2F2LMNACES2
Hydrogen Peroxide SCHEMBL27952375 0.86 LMNA (0.70) MAPTSMN1; SMN2F2LMNACES2
SCHEMBL5314071 0.84 LMNA (0.67) MAPTSMN1; SMN2F2LMNACES2
SCHEMBL431406 0.84 LMNA (0.67) MAPTSMN1; SMN2F2LMNACES2
SCHEMBL7050451 0.84 LMNA (0.67) MAPTSMN1; SMN2F2LMNACES2
SCHEMBL1534569 0.84 LMNA (0.67) MAPTSMN1; SMN2F2LMNACES2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110698659-B Phthalic anhydride polyester polyol and preparation method thereof 万华化学集团股份有限公司 2022-04-22 CN claimed
CN-114230792-A Positive photosensitive polyimide resin, resin composition, and preparation method and application thereof 明士(北京)新材料开发有限公司 2022-03-25 CN claimed
CN-111635526-B Polyether imide polymer containing carboxyl side group and preparation method and application thereof 吉林大学 2021-03-23 CN claimed
CN-111635526-A Polyether imide polymer containing carboxyl side group and preparation method and application thereof 吉林大学 2020-09-08 CN claimed
CN-110951076-A Hyperbranched polyetherimide and preparation and application thereof 北京化工大学 2020-04-03 CN claimed
CN-110698659-A Phthalic anhydride polyester polyol and preparation method thereof 万华化学集团股份有限公司 2020-01-17 CN claimed
US-20180273819-A1 THERMAL ENERGY STORAGE PHASE AND TEMPERATURE STABILIZATION CHANGE MATERIALS COMPRISING TRIAMINES AND METHODS FOR MAKING AND USING THEM ENTROPY SOLUTIONS LLC (US) 2018-09-27 US claimed
WO-2016179028-A1 THERMAL ENERGY STORAGE PHASE AND TEMPERATURE STABILIZATION CHANGE MATERIALS AND METHODS FOR MAKING AND USING THEM ENTROPY SOLUTIONS, LLC. (US) 2016-11-10 WO claimed
US-7247740-B2 Reacting perfluoroalkanesulfonic acid directly with dialkyl carbonate to give alkyl perfluoroalkanesulfonate optionally in the presence of a water or alcohol consuming reagent, and preparing an alkyl perfluoroalkanesulfonate with an alkylamine or alkylphosphine to prepare perfluoroalkanesulfonic acid MERCK PATENT GMBH (DE) 2007-07-24 US claimed
EP-1472217-B1 METHOD FOR PRODUCING PERFLUOROALKANE SULFONIC ACID ESTERS AND THE SALTS THEREOF MERCK PATENT GMBH (DE) 2007-01-24 EP claimed
US-20050085655-A1 Reacting perfluoroalkanesulfonic acid directly with dialkyl carbonate to give alkyl perfluoroalkanesulfonate optionally in the presence of a water or alcohol consuming reagent, and preparing an alkyl perfluoroalkanesulfonate with an alkylamine or alkylphosphine to prepare perfluoroalkanesulfonic acid MERCK PATENT GMBH (DE) 2005-04-21 US claimed
US-12215074-B2 Process for the production of peroxyesters NOURYON CHEMICALS INTERNATIONAL B.V. (NL) 2025-02-04 US disclosed
US-12209065-B2 Process for the production of diacyl peroxides NOURYON CHEMICALS INTERNATIONAL B.V. (NL) 2025-01-28 US disclosed
WO-2025015175-A2 HEATING, VENTILATION, AND AIR CONDITIONING (HVAC) SYSTEMS AND METHODS FOR USING SAME STASIS ENERGY GROUP, LLC (US) 2025-01-16 WO disclosed
US-11976034-B2 Process for the production of diacyl peroxides NOURYON CHEMICALS INTERNATIONAL B.V. (NL) 2024-05-07 US disclosed
US-3933895-A PROSTAGLANDINS, ANTIULCER, ANTICOAGULANTS, NASAL PATENCY, LABOR INDUCERS, WOUND HEALING THE UPJOHN COMPANY (US) 1976-01-20 US disclosed
US-3933896-A ANTICOAGULANTS, ASTHMA, LABOR INDUCERS, CERVICAL DILATION THE UPJOHN COMPANY (US) 1976-01-20 US disclosed
US-3933900-A ANTIULCER, ANTICOAGULANTS, NASAL PATENCY, LABOR INDUCERS, WOUND HEALING THE UPJOHN COMPANY (US) 1976-01-20 US disclosed
US-3933899-A ANTIULCER, ANTICOAGULANTS, NASAL PATENCY, LABOR INDUCERS, WOUND HEALING THE UPJOHN COMPANY (US) 1976-01-20 US disclosed
US-3933897-A ANTIULCER, ASTHMA, RENAL DYSFUNCTION THE UPJOHN COMPANY (US) 1976-01-20 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 (1 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-20050085655-A1 Reacting perfluoroalkanesulfonic acid directly with dialkyl carbonate to give alkyl perfluoroalkanesulfonate optionally in the presence of a water or alcohol consuming reagent, and preparing an alkyl perfluoroalkanesulfonate with an alkylamine or alkylphosphine to prepare perfluoroalkanesulfonic acid PFKFB2, PFKFB3, PHOSPHO1 NPC1 3660/4885RAB9A 3137/4885HPGD 3924/4885

“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.