SCHEMBL22280217

SCHEMBL22280217

N#CNC(=O)/C=C\c1ccc2ccccc2c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.51
CYP3A4 P08684 2/20 0.50
PTPN1 P18031 2/20 0.50
HDAC1 Q13547 2/20 0.50
HDAC3 O15379 1/20 0.50
HDAC4 P56524 1/20 0.50
HDAC7 Q8WUI4 1/20 0.50
HDAC2 Q92769 1/20 0.50
HDAC10 Q969S8 1/20 0.50
HDAC11 Q96DB2 1/20 0.50
HDAC8 Q9BY41 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
HDAC9 Q9UKV0 1/20 0.50
HDAC5 Q9UQL6 1/20 0.50
CNR2 P34972 4/20 0.49
CYP1A2 P05177 2/20 0.48
MEN1 O00255 1/20 0.48
NPC1 O15118 1/20 0.48
CYP2C19 P33261 1/20 0.48
RAB9A P51151 1/20 0.48

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
SCHEMBL12426064 0.81 HDAC1 (0.65) HCAR2PTPN1HDAC1HDAC3HDAC4
SCHEMBL10364182 0.81 HDAC1 (0.65) HCAR2PTPN1HDAC1HDAC3HDAC4
SCHEMBL22280216 0.80 HDAC2 (0.63) HCAR2HDAC1HDAC3HDAC4HDAC7
SCHEMBL7569112 0.80 HDAC2 (0.63) HCAR2HDAC1HDAC3HDAC4HDAC7
SCHEMBL8156532 0.80 CYP3A4 (0.57) HCAR2CYP3A4PTPN1HDAC1HDAC3
SCHEMBL8156528 0.80 CYP3A4 (0.57) HCAR2CYP3A4PTPN1HDAC1HDAC3
SCHEMBL9417997 0.78 APP (0.59) CYP3A4PTPN1HDAC1HDAC3HDAC4
SCHEMBL3273489 0.78 EGFR (0.46) HCAR2CYP3A4PTPN1CYP1A2MEN1
SCHEMBL3273494 0.78 EGFR (0.46) HCAR2CYP3A4PTPN1CYP1A2MEN1
SCHEMBL16198414 0.77 APP (0.69) CYP3A4PTPN1CNR2CYP1A2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11782062-B2 Kits for analysis using nucleic acid encoding and/or label Encodia, Inc. (US) 2023-10-10 US disclosed
US-11782062-B2 Kits for analysis using nucleic acid encoding and/or label Encodia, Inc. (US) 2023-10-10 US disclosed
US-20230236198-A1 KITS FOR ANALYSIS USING NUCLEIC ACID ENCODING AND/OR LABEL Encodia, Inc. (US) 2023-07-27 US disclosed
US-20230236198-A1 KITS FOR ANALYSIS USING NUCLEIC ACID ENCODING AND/OR LABEL Encodia, Inc. (US) 2023-07-27 US disclosed
US-20230168254-A1 KITS FOR ANALYSIS USING NUCLEIC ACID ENCODING AND/OR LABEL Encodia, Inc. (US) 2023-06-01 US disclosed
US-20230168254-A1 KITS FOR ANALYSIS USING NUCLEIC ACID ENCODING AND/OR LABEL Encodia, Inc. (US) 2023-06-01 US disclosed
US-20220127754-A1 METHODS AND COMPOSITIONS OF ACCELERATING REACTIONS FOR POLYPEPTIDE ANALYSIS AND RELATED USES Encodia, Inc. (US) 2022-04-28 US disclosed
US-20200348308-A1 KITS FOR ANALYSIS USING NUCLEIC ACID ENCODING AND/OR LABEL Encodia, Inc. (US) 2020-11-05 US disclosed
US-20200348307-A1 METHODS AND COMPOSITIONS FOR POLYPEPTIDE ANALYSIS Encodia, Inc. (US) 2020-11-05 US disclosed
WO-2020154208-A1 METHODS AND COMPOSITIONS OF ACCELERATING REACTIONS FOR POLYPEPTIDE ANALYSIS AND RELATED USES Encodia, Inc. (US) 2020-07-30 WO disclosed