SCHEMBL9744912

SCHEMBL9744912

O=C(O)C(=CNC1CC1)C(=O)c1ccccc1[N+](=O)[O-]

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.47
▸ L3MBTL1 Q9Y468 2/20 0.45
▸ CTSD P07339 1/20 0.44
▸ KMT2A Q03164 4/20 0.44
▸ MEN1 O00255 3/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ MAPT P10636 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ HTT P42858 1/20 0.42
▸ SMN1; SMN2 Q16637 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
SCHEMBL10863359 0.83 ALDH1A1 (0.47) ALDH1A1L3MBTL1CTSDKMT2ATDP1
SCHEMBL10422233 0.80 HCAR3 (0.38) ALDH1A1L3MBTL1KMT2AMEN1TDP1
SCHEMBL9092971 0.79 ALDH1A1 (0.47) ALDH1A1L3MBTL1CTSDKMT2AMEN1
SCHEMBL9092967 0.79 ALDH1A1 (0.47) ALDH1A1L3MBTL1CTSDKMT2AMEN1
SCHEMBL10718728 0.77 CES1 (0.42) ALDH1A1KMT2AMEN1TDP1MAPT
SCHEMBL10631376 0.77 CES1 (0.42) ALDH1A1KMT2AMEN1TDP1MAPT
SCHEMBL1694617 0.75 ALDH1A1 (0.61) ALDH1A1L3MBTL1CTSDKMT2AMEN1
SCHEMBL15180828 0.75 ALDH1A1 (0.61) ALDH1A1L3MBTL1CTSDKMT2AMEN1
SCHEMBL1670667 0.73 ALDH1A1 (0.65) ALDH1A1L3MBTL1CTSDKMT2AMEN1
SCHEMBL31542074 0.73 ALDH1A1 (0.65) ALDH1A1L3MBTL1CTSDKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5138088-A Nitrobenzoyl-3-cyclopropylaminoacrylates and a process for the preparation thereof KOREA ADVANCED INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 1992-08-11 — — US claimed
US-4965396-A Nitrobenzoyl-3-cyclopropylaminoacrylates and a process for the preparation thereof KOREA ADVANCED INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 1990-10-23 — — US claimed
US-5138088-A Nitrobenzoyl-3-cyclopropylaminoacrylates and a process for the preparation thereof KOREA ADVANCED INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 1992-08-11 — — US disclosed
US-5138088-A Nitrobenzoyl-3-cyclopropylaminoacrylates and a process for the preparation thereof KOREA ADVANCED INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 1992-08-11 — — US disclosed
US-5138088-A Nitrobenzoyl-3-cyclopropylaminoacrylates and a process for the preparation thereof KOREA ADVANCED INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 1992-08-11 — — US disclosed
US-4965396-A Nitrobenzoyl-3-cyclopropylaminoacrylates and a process for the preparation thereof KOREA ADVANCED INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 1990-10-23 — — US disclosed
US-4965396-A Nitrobenzoyl-3-cyclopropylaminoacrylates and a process for the preparation thereof KOREA ADVANCED INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 1990-10-23 — — US disclosed
US-4965396-A Nitrobenzoyl-3-cyclopropylaminoacrylates and a process for the preparation thereof KOREA ADVANCED INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 1990-10-23 — — US disclosed
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