SCHEMBL2344209

SCHEMBL2344209

Cc1ccccc1NC(=O)C(=O)Nc1ccccc1C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 1.00
RAB9A P51151 2/20 1.00
HPGD P15428 5/20 0.72
ALDH1A1 P00352 2/20 0.72
POLB P06746 2/20 0.64
GAA P10253 2/20 0.63
KDM4E B2RXH2 2/20 0.63
TDP1 Q9NUW8 1/20 0.63
ALOX12 P18054 1/20 0.60
MAPT P10636 2/20 0.59
PLA2G1B P04054 1/20 0.59
CYP1A2 P05177 1/20 0.59
CYP2D6 P10635 1/20 0.59
CYP2C9 P11712 1/20 0.59
CYP2C19 P33261 1/20 0.59
NPSR1 Q6W5P4 1/20 0.59
ATG4B Q9Y4P1 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
HTT P42858 2/20 0.58
EPHX1 P07099 1/20 0.58

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
SCHEMBL31411480 1.00 NPC1 (1.00) NPC1RAB9AHPGDALDH1A1POLB
SCHEMBL6857852 0.94 NPC1 (0.88) NPC1RAB9AHPGDALDH1A1POLB
SCHEMBL9503475 0.90 NPC1 (0.81) NPC1RAB9AHPGDALDH1A1POLB
SCHEMBL3723177 0.89 RAB9A (0.80) NPC1RAB9AHPGDALDH1A1POLB
SCHEMBL30852954 0.89 RAB9A (0.80) NPC1RAB9AHPGDALDH1A1POLB
SCHEMBL25356036 0.87 NPC1 (0.77) NPC1RAB9AHPGDALDH1A1POLB
SCHEMBL8006309 0.87 NPC1 (0.77) NPC1RAB9AHPGDALDH1A1POLB
SCHEMBL5580334 0.87 NPC1 (0.77) NPC1RAB9AHPGDALDH1A1POLB
SCHEMBL959541 0.87 NPC1 (0.77) NPC1RAB9AHPGDALDH1A1POLB
SCHEMBL13070081 0.87 RAB9A (0.75) NPC1RAB9AHPGDALDH1A1POLB

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
EP-3792241-B1 METHOD FOR CONVERTING HYDROXYL GROUP OF ALCOHOL TAKASAGO PERFUMERY CO LTD (JP) 2026-04-22 EP disclosed
US-11407703-B2 Method for converting hydroxyl group of alcohol TAKASAGO INTERNATIONAL CORPORATION (JP) 2022-08-09 US disclosed
EP-3792241-A1 METHOD FOR CONVERTING HYDROXYL GROUP OF ALCOHOL Takasago International Corporation (JP) 2021-03-17 EP disclosed
EP-3792241-A1 METHOD FOR CONVERTING HYDROXYL GROUP OF ALCOHOL Takasago International Corporation (JP) 2021-03-17 EP disclosed
US-20210047254-A1 METHOD FOR CONVERTING HYDROXYL GROUP OF ALCOHOL TAKASAGO INTERNATIONAL CORPORATION (JP) 2021-02-18 US disclosed
US-20210047254-A1 METHOD FOR CONVERTING HYDROXYL GROUP OF ALCOHOL TAKASAGO INTERNATIONAL CORPORATION (JP) 2021-02-18 US disclosed
WO-2019216355-A1 METHOD FOR CONVERTING HYDROXYL GROUP OF ALCOHOL 高砂香料工業株式会社 (JP) 2019-11-14 WO disclosed
US-8361922-B2 Organometallic ruthenium complexes and related methods for the preparation of tetra-substituted and other hindered olefins MATERIA, INC. (US) 2013-01-29 US disclosed
US-20120123133-A1 ORGANOMETALLIC RUTHENIUM COMPLEXES AND RELATED METHODS FOR THE PREPARATION OF TETRA-SUBSTITUTED AND OTHER HINDERED OLEFINS CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2012-05-17 US disclosed
US-8008224-B2 Organometallic ruthenium complexes and related methods for the preparation of tetra-substituted and other hindered olefins MATERIA, INC. (US) 2011-08-30 US disclosed
US-20070282148-A1 Organometallic ruthenium complexes and related methods for the preparation of tetra-substituted and other hindered olefins CALIFORNIA INSTITUTE OF TECHNOLOGY 2007-12-06 US disclosed
US-6737193-B2 ACTIVE MATERIALS IN THE POSITIVE ELECTRODES OF BATTERIES. NOVEL METHODS FOR PREPARING THE TETRAKETOPIPERAZINE UNIT-CONTAINING COMPOUNDS INCLUDE: (I) REACTING AN OXALYL HALIDE AND AN OXAMIDE, AND ADDING WATER OR AN AQUEOUS ALKALI IM&T RESEARCH, INC. 2004-05-18 US disclosed
US-20030148188-A1 Active materials in the positive electrodes of batteries. Novel methods for preparing the tetraketopiperazine unit-containing compounds include: (i) reacting an oxalyl halide and an oxamide, and adding water or an aqueous alkali IM&T RESEARCH, INC. 2003-08-07 US disclosed
EP-0309619-B1 RADIATION SENSITIVE ACRYLATE COMPOSITION Polychrome Corporation (US) 1993-01-27 EP disclosed
EP-0309619-A1 Radiation sensitive acrylate composition Polychrome Corporation (US) 1989-04-05 EP disclosed
US-4782005-A N,N'-diorgano dicarboxamides as oxygen inhibitors in radiation sensitive acrylate compositions POLYCHROME CORP. (US) 1988-11-01 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-20120123133-A1 ORGANOMETALLIC RUTHENIUM COMPLEXES AND RELATED METHODS FOR THE PREPARATION OF TETRA-SUBSTITUTED AND OTHER HINDERED OLEFINS ORC3, OXER1, CBR3 NPC1 1521/4885RAB9A 3479/4885HPGD 1250/4885
US-20070282148-A1 Organometallic ruthenium complexes and related methods for the preparation of tetra-substituted and other hindered olefins ORC3, OXER1, CBR3 NPC1 1521/4885RAB9A 3479/4885HPGD 1250/4885
US-11407703-B2 Method for converting hydroxyl group of alcohol ADH1C, CBR1, NAP1L4 NPC1 1736/4885RAB9A 2827/4885HPGD 915/4885
US-20210047254-A1 METHOD FOR CONVERTING HYDROXYL GROUP OF ALCOHOL ADH1C, CBR1, NAP1L4 NPC1 1736/4885RAB9A 2827/4885HPGD 915/4885

“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.