SCHEMBL56581

SCHEMBL56581

Nc1ccc(OCCO)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 3/20 0.65
ALDH1A1 P00352 3/20 0.60
RECQL P46063 1/20 0.60
TDP1 Q9NUW8 3/20 0.55
TSHR P16473 2/20 0.54
RAB9A P51151 2/20 0.53
NR1I2 O75469 1/20 0.53
NPC1 O15118 1/20 0.53
GAA P10253 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.48
CYP3A4 P08684 2/20 0.48
NFE2L2 Q16236 1/20 0.48
MAPT P10636 2/20 0.47
KMT2A Q03164 1/20 0.47
MAOA P21397 1/20 0.47
MAOB P27338 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
LTA4H P09960 1/20 0.46
PTGS1 P23219 1/20 0.46
PTGS2 P35354 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
Hydrochloric Acid SCHEMBL7442271 0.98 APP (0.62) APPALDH1A1RECQLTDP1TSHR
SCHEMBL7143447 0.96 APP (0.61) APPALDH1A1RECQLTDP1TSHR
SCHEMBL3541139 0.88 APP (0.58) APPALDH1A1RECQLTDP1TSHR
SCHEMBL2938783 0.87 APP (0.83) APPALDH1A1RECQLTDP1TSHR
SCHEMBL12012119 0.87 APP (0.83) APPALDH1A1RECQLTDP1TSHR
SCHEMBL48239 0.87 ALDH1A1 (0.75) APPALDH1A1RECQLNR1I2GAA
SCHEMBL14724511 0.87 APP (0.53) APPALDH1A1RECQLTDP1TSHR
SCHEMBL12143990 0.87 APP (0.83) APPALDH1A1RECQLTDP1TSHR
SCHEMBL12012118 0.87 APP (0.83) APPALDH1A1RECQLTDP1TSHR
SCHEMBL12012117 0.87 APP (0.83) APPALDH1A1RECQLTDP1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115108931-B Tofenamic acid derivative and preparation and application thereof 南华大学附属第一医院 2024-06-14 CN claimed
CN-115108931-A Tofenamic acid derivative and preparation and application thereof 南华大学附属第一医院 2022-09-27 CN claimed
EP-2507243-B1 SPIROINDOLINONE PYRROLIDINES HOFFMANN LA ROCHE (CH) 2015-06-10 EP claimed
US-8354444-B2 Substituted pyrrolidine-2-carboxamides HOFFMANN-LA ROCHE INC. (US) 2013-01-15 US claimed
EP-2340021-B1 SUBSTITUTED PYRROLIDINE-2-CARBOXAMIDES HOFFMANN LA ROCHE (CH) 2012-11-07 EP claimed
EP-2507243-A1 SPIROINDOLINONE PYRROLIDINES F. Hoffmann-La Roche AG (CH) 2012-10-10 EP claimed
US-20100152190-A1 Substituted Pyrrolidine-2-Carboxamides F. HOFFMANN-LA ROCHE AG (CH) 2010-06-17 US claimed
WO-2010031713-A1 SUBSTITUTED PYRROLIDINE-2-CARBOXAMIDES F. HOFFMANN-LA ROCHE AG (CH) 2010-03-25 WO claimed
US-20100075948-A1 Substituted Pyrrolidine-2-Carboxamides DING QINGJIE 2010-03-25 US claimed
EP-0681005-A1 Triphendioxazine reactive dyes BAYER AG (DE) 1995-11-08 EP claimed
EP-0322643-B1 MEDICINES CONTAINING AS A MIXTURE INTERFERON AND 1-DESOXY-PIPERIDINOSES, PROCESS FOR THEIR MANUFACTURE AND THEIR USE BAYER AG (DE) 1991-07-24 EP claimed
US-20250257069-A1 JAK INHIBITOR ANALOGS, FORMULATIONS, AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF MICHIGAN 2025-08-14 US disclosed
CN-119923257-A JAK inhibitor analogues, formulations and uses thereof 密歇根大学董事会 2025-05-02 CN disclosed
WO-2025054339-A1 TRIAZOLOPYRIDINE COMPOUNDS AS INHIBITORS OF KIT ARCUS BIOSCIENCES, INC. (US) 2025-03-13 WO disclosed
US-20240254136-A1 COMPOUNDS TARGETING RNA-BINDING PROTEINS OR RNA-MODIFYING PROTEINS Redona Therapeutics, Inc. 2024-08-01 US disclosed
US-3992421-A ANTHRAQUINONE DYESTUFFS FOR BLUE DYEINGS OF POLYESTERS AMERICAN COLOR & CHEMICAL CORPORATION (US) 1976-11-16 US disclosed
US-3989450-A DYEING AND PRINTING SYNTHETIC FIBERS BAYER AKTIENGESELLSCHAFT (DT) 1976-11-02 US disclosed
US-3980677-A Anthraquinone dyestuffs containing sulphonic acid groups BAYER AKTIENGESELLSCHAFT (DT) 1976-09-14 US disclosed
US-3956267-A Indole-containing disazo dyestuffs having a sulfatoalkyleneoxy-substituent BAYER AKTIENGESELLSCHAFT (DT) 1976-05-11 US disclosed
US-3935248-A POLYAMIDES IMPERIAL CHEMICAL INDUSTRIES LIMITED (EN) 1976-01-27 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 (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-20100152190-A1 Substituted Pyrrolidine-2-Carboxamides ARG2, CCNY, PYCR1 APP 4606/4885ALDH1A1 2027/4885RECQL 536/4885
US-20250257069-A1 JAK INHIBITOR ANALOGS, FORMULATIONS, AND USES THEREOF JAK1, JAK3, JAK2 APP 4740/4885ALDH1A1 2402/4885RECQL 3223/4885
US-20100075948-A1 Substituted Pyrrolidine-2-Carboxamides ARG2, CCNY, PYCR1 APP 4606/4885ALDH1A1 2027/4885RECQL 536/4885
US-20240254136-A1 COMPOUNDS TARGETING RNA-BINDING PROTEINS OR RNA-MODIFYING PROTEINS NSUN3, NSUN2, RBM3 APP 3367/4885ALDH1A1 3491/4885RECQL 1027/4885

“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.