SCHEMBL29700879

SCHEMBL29700879

CN(C)CCCOc1ccc(-c2cnc3c(-c4ccnc5ccccc45)cnn3c2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ACVR1 Q04771 11/20 1.00
▸ KDR P35968 8/20 1.00
▸ TGFBR1 P36897 6/20 1.00
▸ PRKAB1 Q9Y478 6/20 1.00
▸ ACVR1B P36896 10/20 0.72
▸ BMP4 P12644 9/20 0.72
▸ BMPR1B O00238 9/20 0.72
▸ ACVRL1 P37023 9/20 0.72
▸ BMPR1A P36894 6/20 0.72
▸ TGFBR2 P37173 4/20 0.72
▸ FLT1 P17948 1/20 0.62
▸ FLT4 P35916 1/20 0.62
▸ BMPR2 Q13873 3/20 0.58
▸ RIPK2 O43353 1/20 0.56
▸ ACVR2A P27037 1/20 0.56
▸ ACVR2B Q13705 1/20 0.56

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
SCHEMBL14671967 1.00 ACVR1 (1.00) ACVR1KDRTGFBR1PRKAB1ACVR1B
SCHEMBL11953447 0.84 BMP4 (1.00) ACVR1KDRTGFBR1PRKAB1ACVR1B
SCHEMBL11953444 0.83 BMP4 (1.00) ACVR1KDRTGFBR1PRKAB1ACVR1B
SCHEMBL11953448 0.81 BMP4 (1.00) ACVR1KDRTGFBR1PRKAB1ACVR1B
SCHEMBL29360662 0.81 ACVR1 (1.00) ACVR1KDRTGFBR1PRKAB1ACVR1B
SCHEMBL14671947 0.81 ACVR1 (1.00) ACVR1KDRTGFBR1PRKAB1ACVR1B
SCHEMBL15996325 0.81 KDR (0.76) ACVR1KDRTGFBR1PRKAB1ACVR1B
SCHEMBL24412157 0.81 ACVR1 (0.68) ACVR1KDRTGFBR1PRKAB1ACVR1B
SCHEMBL12779920 0.81 BMP4 (0.82) ACVR1KDRTGFBR1PRKAB1ACVR1B
SCHEMBL18069324 0.81 BMP4 (0.82) ACVR1KDRTGFBR1PRKAB1ACVR1B

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240119889-A1 DISPLAY DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2024-04-11 — — US disclosed
CN-117858557-A Display device 三星显示有限公司 2024-04-09 — — CN disclosed
US-20230225122-A1 SEMICONDUCTOR DEVICE KIOXIA CORPORATION (JP) 2023-07-13 — — US disclosed
WO-2022112809-A1 EFFICIENT AND RAPID SPECIFICATION OF SPINAL NEURONAL SUBTYPES FROM HUMAN PLURIPOTENT STEM CELLS INSERM (INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE) (FR) 2022-06-02 — — WO disclosed
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