SCHEMBL24810064

SCHEMBL24810064

CC(C)C(=O)CCNc1ccc2ccc3cccc4ccc1c2c34

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.52
HPGD P15428 5/20 0.52
KDM4E B2RXH2 5/20 0.52
MAPT P10636 3/20 0.52
KMT2A Q03164 4/20 0.43
MEN1 O00255 3/20 0.43
HSD17B10 Q99714 4/20 0.40
CYP1A2 P05177 2/20 0.40
POLB P06746 2/20 0.40
GLA P06280 1/20 0.40
CYP2D6 P10635 1/20 0.40
HDAC1 Q13547 2/20 0.40
HDAC6 Q9UBN7 2/20 0.40
HDAC7 Q8WUI4 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
CA12 O43570 1/20 0.40
CA4 P22748 1/20 0.40
CA7 P43166 1/20 0.40
CA9 Q16790 1/20 0.40
CA14 Q9ULX7 1/20 0.40

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
SCHEMBL25718059 0.84 HPGD (0.60) ALDH1A1HPGDKDM4EMAPTKMT2A
SCHEMBL25718433 0.82 ALDH1A1 (0.54) ALDH1A1HPGDKDM4EMAPTKMT2A
SCHEMBL24809227 0.81 ALDH1A1 (0.52) ALDH1A1HPGDKDM4EMAPTKMT2A
SCHEMBL2320494 0.76 ALDH1A1 (0.51) ALDH1A1HPGDKDM4EMAPTKMT2A
SCHEMBL17119894 0.75 KMT2A (0.57) ALDH1A1HPGDKDM4EMAPTKMT2A
Hydrochloric Acid SCHEMBL18191903 0.74 ALDH1A1 (0.50) ALDH1A1HPGDKDM4EMAPTKMT2A
SCHEMBL2315443 0.73 MAPT (0.50) ALDH1A1HPGDKDM4EMAPTKMT2A
SCHEMBL9891448 0.73 KDM4E (0.47) ALDH1A1HPGDKDM4EMAPTKMT2A
SCHEMBL1672450 0.72 TOP2A (0.48) ALDH1A1HPGDKDM4EMAPTHSD17B10
SCHEMBL29156708 0.72 ALDH1A1 (0.54) ALDH1A1HPGDKDM4EMAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230193361-A1 METHODS AND COMPOSITIONS USEFUL FOR NUCLEIC ACID SEQUENCING FIRST-CITIZENS BANK & TRUST COMPANY 2023-06-22 US disclosed
US-20230193361-A1 METHODS AND COMPOSITIONS USEFUL FOR NUCLEIC ACID SEQUENCING FIRST-CITIZENS BANK & TRUST COMPANY 2023-06-22 US disclosed
WO-2022271970-A1 METHODS AND COMPOSITIONS USEFUL FOR NUCLEIC ACID SEQUENCING Singular Genomics Systems, Inc. (US) 2022-12-29 WO disclosed