SCHEMBL838148

SCHEMBL838148

Cc1ccc(C)c(NN)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAPGEF4 Q8WZA2 2/20 0.54
ALDH1A1 P00352 4/20 0.52
GAA P10253 2/20 0.52
HTT P42858 2/20 0.52
KDM4E B2RXH2 2/20 0.52
TDP1 Q9NUW8 1/20 0.48
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
POLB P06746 2/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2D6 P10635 1/20 0.43
LMNA P02545 2/20 0.41
HCRTR1 O43613 1/20 0.41
HDAC3 O15379 1/20 0.41
HDAC4 P56524 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC7 Q8WUI4 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC10 Q969S8 1/20 0.41
HDAC11 Q96DB2 1/20 0.41

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
SCHEMBL30951588 1.00 RAPGEF4 (0.54) RAPGEF4ALDH1A1GAAHTTKDM4E
Hydrochloric Acid SCHEMBL31082291 0.98 RAPGEF4 (0.52) RAPGEF4ALDH1A1GAAHTTKDM4E
Hydrochloric Acid SCHEMBL839579 0.98 RAPGEF4 (0.52) RAPGEF4ALDH1A1GAAHTTKDM4E
SCHEMBL1010790 0.80 RAPGEF4 (0.56) RAPGEF4ALDH1A1GAAHTTTDP1
SCHEMBL29401670 0.80 RAPGEF4 (0.56) RAPGEF4ALDH1A1GAAHTTTDP1
SCHEMBL9224102 0.79 GAA (0.65) RAPGEF4ALDH1A1GAAHTTKDM4E
SCHEMBL29196035 0.79 RAPGEF4 (0.71) RAPGEF4ALDH1A1GAAHTTKDM4E
SCHEMBL10385157 0.78 MAPT (0.41) RAPGEF4ALDH1A1GAAHTTKDM4E
Hydrochloric Acid SCHEMBL30977785 0.78 RAPGEF4 (0.54) RAPGEF4ALDH1A1GAAHTTTDP1
Hydrochloric Acid SCHEMBL1012671 0.78 RAPGEF4 (0.54) RAPGEF4ALDH1A1GAAHTTTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0918052-B1 Improved polymeric mdi color BAYER AG (US) 2003-05-28 EP claimed
US-20250011319-A1 SUBSTITUTED 1H-PYRAZOLO [4,3-c] QUINOLINES, METHODS OF PREPARATION, AND USE THEREOF LOMOND THERAPEUTICS, INC. 2025-01-09 US disclosed
US-11999734-B2 Compounds and compositions for the treatment of cystic fibrosis FONDAZIONE ISTITUTO ITALIANO DI TECNOLOGIA (IT) 2024-06-04 US disclosed
CN-118076605-A Substituted 1H-pyrazolo [4,3-c ] quinolines, methods of preparation and uses thereof 洛蒙治疗公司 2024-05-24 CN disclosed
EP-3820867-B1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF CYSTIC FIBROSIS FONDAZIONE ST ITALIANO TECNOLOGIA (IT) 2023-09-13 EP disclosed
CN-116655536-A Class N 1 -aryl-3-fluoroalkyl-5-fluoropyrazole compound, and preparation method and application thereof 天津大学 2023-08-29 CN disclosed
CN-115707334-A Method for rubber regeneration A·A·斯拉涅夫斯基 2023-02-17 CN disclosed
CN-112409203-B Method for simultaneously synthesizing phenylhydrazine salt and pyruvic acid or glyoxylic acid 帕潘纳(北京)科技有限公司 2022-10-25 CN disclosed
US-20210292324-A1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF CYSTIC FIBROSIS ISTITUTO GIANNINA GASLINI (IT) 2021-09-23 US disclosed
EP-3820867-A1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF CYSTIC FIBROSIS Fondazione Istituto Italiano di Tecnologia (IT) 2021-05-19 EP disclosed
EP-1042319-A1 DIHYDROBENZOFURANS Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 2000-10-11 EP disclosed
EP-0971901-A1 PHTHALAZINONES Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 2000-01-19 EP disclosed
WO-1999031090-A1 DIHYDROBENZOFURANS BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1999-06-24 WO disclosed
WO-1998031674-A1 PHTHALAZINONES BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1998-07-23 WO disclosed
EP-0486900-B1 Process for the preparation of indoles BAYER AG (DE) 1996-09-04 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-5017454-A Electron transfer compound containing pyrazole ring FUJI PHOTO FILM CO., LTD. (JP) 1991-05-21 US disclosed
US-4325962-A ANTIINFLAMMATORY AGENTS, ANALGESICS, ANTIDYRETICS BYK-GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1982-04-20 US disclosed
US-4146721-A ANALGESICS, ANTIINFLAMMATORY AGENTS AND ANTIPYRETICS BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1979-03-27 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 (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-11999734-B2 Compounds and compositions for the treatment of cystic fibrosis CFTR, ABCB11, ABCC5 RAPGEF4 2093/4885ALDH1A1 2608/4885GAA 660/4885
US-20250011319-A1 SUBSTITUTED 1H-PYRAZOLO [4,3-c] QUINOLINES, METHODS OF PREPARATION, AND USE THEREOF FLT3, PDXK, PHKG1 RAPGEF4 3198/4885ALDH1A1 2059/4885GAA 2598/4885
US-20210292324-A1 COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF CYSTIC FIBROSIS CFTR, ABCB11, ABCC5 RAPGEF4 2093/4885ALDH1A1 2608/4885GAA 660/4885

“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.