SCHEMBL543832

SCHEMBL543832

Nc1c(-c2ccccc2)nnn1-c1ccccc1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.78
RAB9A P51151 4/20 0.78
TP53 P04637 3/20 0.78
MEN1 O00255 1/20 0.78
KMT2A Q03164 1/20 0.78
SMN1; SMN2 Q16637 2/20 0.62
GABRA2 P47869 1/20 0.52
GABRB2 P47870 1/20 0.52
POLB P06746 2/20 0.47
KDM4E B2RXH2 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
IDO1 P14902 1/20 0.45
TDO2 P48775 1/20 0.45
SRC P12931 3/20 0.44
EGFR P00533 1/20 0.44
DHODH Q02127 1/20 0.44
ADORA2A P29274 1/20 0.41
ADORA1 P30542 1/20 0.41
BRAF P15056 2/20 0.41
KDR P35968 2/20 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
SCHEMBL14132957 0.88 NPC1 (0.63) NPC1RAB9ATP53MEN1KMT2A
SCHEMBL27820980 0.88 NPC1 (0.88) NPC1RAB9ATP53MEN1KMT2A
SCHEMBL27840462 0.85 NPC1 (0.68) NPC1RAB9ATP53MEN1KMT2A
SCHEMBL23405480 0.81 NPC1 (0.55) NPC1RAB9ATP53MEN1KMT2A
SCHEMBL44422 0.78 NPC1 (0.65) NPC1RAB9ATP53MEN1KMT2A
SCHEMBL23405473 0.77 POLB (0.54) NPC1RAB9ATP53MEN1KMT2A
Hydrochloric Acid SCHEMBL28572130 0.77 NPC1 (0.62) NPC1RAB9ATP53MEN1KMT2A
SCHEMBL13325667 0.77 NPC1 (0.62) NPC1RAB9ATP53MEN1KMT2A
SCHEMBL18529892 0.77 NPC1 (0.57) NPC1RAB9ATP53MEN1KMT2A
SCHEMBL28814498 0.74 NPC1 (0.47) NPC1RAB9ATP53MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120029007-A Colored photosensitive resin composition, partition wall, organic electroluminescent element, image display device, and illumination 三菱化学株式会社 2025-05-23 CN disclosed
CN-112313579-B Photosensitive colored resin composition, cured product, image display device, and illumination 三菱化学株式会社 2025-05-13 CN disclosed
CN-111566561-B Colored photosensitive resin composition, partition wall, organic electroluminescent element, image display device, and illumination 三菱化学株式会社 2025-02-14 CN disclosed
CN-119404143-A Photosensitive resin composition, cured product, method for forming same, partition wall, and image display device 三菱化学株式会社 2025-02-07 CN disclosed
CN-119096172-A Pigment dispersion, photosensitive resin composition, cured product, black matrix, and image display device 三菱化学株式会社 2024-12-06 CN disclosed
CN-113993922-B Photosensitive coloring resin composition, cured product, partition wall and image display device 三菱化学株式会社 2024-11-19 CN disclosed
CN-118891333-A Pigment dispersion, photosensitive resin composition, cured product, black matrix, image display device, and method for producing pigment dispersion 三菱化学株式会社 2024-11-01 CN disclosed
CN-118843832-A Photosensitive resin composition, cured product, black matrix, and image display device 三菱化学株式会社 2024-10-25 CN disclosed
CN-118843833-A Photosensitive resin composition, pigment dispersion, cured product, black matrix, and image display device 三菱化学株式会社 2024-10-25 CN disclosed
WO-2024214806-A1 PIGMENT DISPERSION LIQUID, PHOTOSENSITIVE RESIN COMPOSITION, CURED PRODUCT, BLACK MATRIX, AND IMAGE DISPLAY DEVICE 三菱ケミカル株式会社 2024-10-17 WO disclosed
US-7244851-B2 1-[2-Cyclohexyl-2-(2-methylamino-propionylamino)-acetyl]-pyrrolidine-2-carboxylic acid (2-phenyl-2H-pyrazol-3-yl)-amide; inhibitors of IAP, for treating malignancies GENENTECH, INC. (US) 2007-07-17 US disclosed
US-7244851-B2 1-[2-Cyclohexyl-2-(2-methylamino-propionylamino)-acetyl]-pyrrolidine-2-carboxylic acid (2-phenyl-2H-pyrazol-3-yl)-amide; inhibitors of IAP, for treating malignancies GENENTECH, INC. (US) 2007-07-17 US disclosed
EP-1778718-A1 INHIBITORS OF IAP Genentech, Inc. (US) 2007-05-02 EP disclosed
CN-1918515-A Curable resin composition, color filter and liquid crystal display device MITSUBISHI CHEM CORP (JP) 2007-02-21 CN disclosed
CN-1906524-A Resin composition for liquid crystal panel, color filter using the same, and liquid crystal panel MITSUBISHI CHEM CORP (JP) 2007-01-31 CN disclosed
CN-1906536-A Photosensitive resin composition, color filter and liquid crystal display MITSUBISHI CHEM CORP (JP) 2007-01-31 CN disclosed
WO-2006014361-A1 INHIBITORS OF IAP GENENTECH, INC. (US) 2006-02-09 WO disclosed
US-20060014700-A1 1-[2-Cyclohexyl-2-(2-methylamino-propionylamino)-acetyl]-pyrrolidine-2-carboxylic acid (2-phenyl-2H-pyrazol-3-yl)-amide; inhibitors of IAP, for treating malignancies GENENTECH, INC. (US) 2006-01-19 US disclosed
US-5914206-A RESIN BLACK MATRIX HAS A 20.DEGREE. SPECULAR GLOSSINESS OF FROM 100 TO 200. MITSUBISHI CHEMICAL CORPORATION (JP) 1999-06-22 US disclosed
EP-0816899-A2 Color filter and black resist composition MITSUBISHI CHEMICAL CORPORATION (JP) 1998-01-07 EP 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-20060014700-A1 1-[2-Cyclohexyl-2-(2-methylamino-propionylamino)-acetyl]-pyrrolidine-2-carboxylic acid (2-phenyl-2H-pyrazol-3-yl)-amide; inhibitors of IAP, for treating malignancies BIRC5, BIRC2, XIAP NPC1 3490/4885RAB9A 1950/4885TP53 43/4885

“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.