SCHEMBL6821181

SCHEMBL6821181

Cc1ccc(Cl)cc1NN

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.59
MAPT P10636 2/20 0.59
RAPGEF4 Q8WZA2 2/20 0.55
CYP3A4 P08684 1/20 0.52
KDM4E B2RXH2 1/20 0.51
POLB P06746 1/20 0.47
ALDH1A1 P00352 3/20 0.46
LMNA P02545 1/20 0.46
TSHR P16473 1/20 0.44

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 SCHEMBL403976 0.98 GAA (0.58) GAAMAPTRAPGEF4CYP3A4KDM4E
SCHEMBL1999098 0.82 GAA (0.55) GAAMAPTRAPGEF4CYP3A4POLB
Hydrochloric Acid SCHEMBL1402959 0.80 GAA (0.53) GAAMAPTRAPGEF4CYP3A4POLB
SCHEMBL9232234 0.79 RAPGEF4 (0.57) GAAMAPTRAPGEF4CYP3A4KDM4E
SCHEMBL27924446 0.79 RAPGEF4 (0.57) GAAMAPTRAPGEF4CYP3A4KDM4E
SCHEMBL11287941 0.77 RAPGEF4 (0.55) GAAMAPTRAPGEF4CYP3A4KDM4E
SCHEMBL838148 0.76 RAPGEF4 (0.54) GAARAPGEF4KDM4EPOLBALDH1A1
SCHEMBL29710420 0.76 IDO1 (0.57) MAPTRAPGEF4CYP3A4KDM4EPOLB
SCHEMBL1132624 0.76 IDO1 (0.57) MAPTRAPGEF4CYP3A4KDM4EPOLB
SCHEMBL30951588 0.76 RAPGEF4 (0.54) GAARAPGEF4KDM4EPOLBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023118267-A1 NOVEL GALACTOSIDE INHIBITOR OF GALECTINS GALECTO BIOTECH AB (DK) 2023-06-29 WO disclosed
WO-2023118267-A1 NOVEL GALACTOSIDE INHIBITOR OF GALECTINS GALECTO BIOTECH AB (DK) 2023-06-29 WO disclosed
US-20220389020-A1 PYRAZOLOPYRIMIDINE JAK INHIBITOR COMPOUNDS AND METHODS GENENTECH, INC. (US) 2022-12-08 US disclosed
EP-3670514-A1 PYRAZOLOPYRIMIDINE JAK INHIBITOR COMPOUNDS AND METHODS Genentech, Inc. (US) 2020-06-24 EP disclosed
US-10577327-B2 Pyridine based ionic fluoride for catalyzing indole and tetrazole formation KING ABDULAZIZ UNIVERSITY (SA) 2020-03-03 US disclosed
US-9840470-B2 Targeting GLI proteins in human cancer by small molecules THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2017-12-12 US disclosed
US-9840470-B2 Targeting GLI proteins in human cancer by small molecules THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2017-12-12 US disclosed
US-20170283424-A1 PYRAZOLOPYRIMIDINE JAK INHIBITOR COMPOUNDS AND METHODS GENENTECH, INC. (US) 2017-10-05 US disclosed
EP-2734042-B1 TARGETING GLI PROTEINS IN HUMAN CANCER BY SMALL MOLECULES UNIV CALIFORNIA (US) 2017-02-01 EP disclosed
EP-3061749-A1 QUINAZOLINONE AND ISOQUINOLINONE DERIVATIVE Chugai Seiyaku Kabushiki Kaisha (JP) 2016-08-31 EP disclosed
EP-0486900-B1 Process for the preparation of indoles BAYER AG (DE) 1996-09-04 EP disclosed
EP-0673781-A1 Recording sheets containing amine salts and quaternary choline halides XEROX CORPORATION (US) 1995-09-27 EP disclosed
US-5179211-A PROCESS FOR THE PREPARATION OF INDOLES BAYER AKTIENGESELLSCHAFT (DE) 1993-01-12 US disclosed
EP-0486900-A2 Process for the preparation of indoles BAYER AG (DE) 1992-05-27 EP disclosed
US-4771063-A PLANTS MONTEDISON S.P.A (IT) 1988-09-13 US disclosed
US-4069377-A Polymerization of ethylenically unsaturated monomers employing secondary-aliphatic α-substituted azoalkanes PENNWALT CORPORATION 1978-01-17 US disclosed
US-4028344-A FOAMING AGENTS, FREE RADICAL INITIATORS PENNWALT CORPORATION (US) 1977-06-07 US disclosed
US-4025502-A POLYMERIZATION CATALYSTS, CURING AGENTS PENNWALT CORPORATION (US) 1977-05-24 US disclosed
US-3979412-A Process for producing 3-anilino-5-pyrazolones FUJI PHOTO FILM CO., LTD. (JA) 1976-09-07 US disclosed
US-3933874-A Method for preparing of β-anilino-β-hydrazinoacrylates FUJI PHOTO FILM CO., LTD. (JA) 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 (3 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-20220389020-A1 PYRAZOLOPYRIMIDINE JAK INHIBITOR COMPOUNDS AND METHODS JAK1, JAK2, JAK3 GAA 3202/4885MAPT 602/4885RAPGEF4 3491/4885
US-10577327-B2 Pyridine based ionic fluoride for catalyzing indole and tetrazole formation FLI1, ABL1, INMT GAA 4236/4885MAPT 1723/4885RAPGEF4 912/4885
US-20170283424-A1 PYRAZOLOPYRIMIDINE JAK INHIBITOR COMPOUNDS AND METHODS JAK1, JAK2, JAK3 GAA 3202/4885MAPT 602/4885RAPGEF4 3491/4885

“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.