SCHEMBL21772202

SCHEMBL21772202

C=CC(=O)NCCNC(=O)c1ccc(C(=O)c2ccc(O)c(O)c2O)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.46
HPGD P15428 3/20 0.46
KDM4E B2RXH2 2/20 0.46
MAPT P10636 2/20 0.46
ALOX15 P16050 2/20 0.46
RECQL P46063 2/20 0.46
HSD17B10 Q99714 2/20 0.46
HDAC1 Q13547 1/20 0.44
LMNA P02545 2/20 0.40
ALOX5 P09917 1/20 0.38
NME4 O00746 1/20 0.38
ADORA3 P0DMS8 1/20 0.38
CHRM1 P11229 1/20 0.38
ADORA2A P29274 1/20 0.38
AVPR2 P30518 1/20 0.38
AGTR1 P30556 1/20 0.38
SLC6A4 P31645 1/20 0.38
AVPR1A P37288 1/20 0.38
HTR3A P46098 1/20 0.38
GCDH Q92947 1/20 0.38

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
SCHEMBL21772208 0.88 HSD17B10 (0.47) ALDH1A1HPGDKDM4EMAPTALOX15
SCHEMBL21772201 0.81 LMNA (0.48) ALDH1A1HPGDLMNAPOLB
SCHEMBL16711125 0.75 ALDH1A1 (0.50) ALDH1A1HPGDMAPTLMNATDP1
SCHEMBL3656665 0.74 HDAC1 (0.73) ALDH1A1HPGDKDM4EMAPTALOX15
SCHEMBL21783906 0.74 HPGD (0.58) ALDH1A1HPGDKDM4EMAPTALOX15
SCHEMBL19888923 0.74 LMNA (0.59) ALDH1A1HPGDKDM4ERECQLHDAC1
SCHEMBL13644432 0.72 TRPV1 (0.47) ALDH1A1HPGDLMNAPOLB
SCHEMBL8744847 0.70 HDAC1 (0.62) ALDH1A1HPGDKDM4EMAPTALOX15
SCHEMBL21772197 0.70 SCN1A (0.59) ALDH1A1HPGDHDAC1LMNAPOLB
SCHEMBL93340 0.69 HDAC1 (0.66) ALDH1A1HPGDKDM4EMAPTALOX15

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-10703835-B2 Hyperbranched cationic mussel-imitated polymer and method of preparing the same Sichuan Huili Industry Co., Ltd. (CN) 2020-07-07 US claimed
US-20200071433-A1 HYPERBRANCHED CATIONIC MUSSEL-IMITATED POLYMER AND METHOD OF PREPARING THE SAME Sichuan Huili Industry Co., Ltd. (CN) 2020-03-05 US claimed
US-11318724-B2 Film for medicine packaging and method of preparing the same Sichuan Huili Industry Co., Ltd. (CN) 2022-05-03 US disclosed
US-20200282714-A1 FILM FOR MEDICINE PACKAGING AND METHOD OF PREPARING THE SAME SICHUAN HUILI IND CO LTD (CN) 2020-09-10 US disclosed
US-10703835-B2 Hyperbranched cationic mussel-imitated polymer and method of preparing the same Sichuan Huili Industry Co., Ltd. (CN) 2020-07-07 US disclosed
US-10703080-B2 Film for medicine packaging and method of preparing the same Sichuan Huili Industry Co., Ltd. (CN) 2020-07-07 US disclosed
US-20200071433-A1 HYPERBRANCHED CATIONIC MUSSEL-IMITATED POLYMER AND METHOD OF PREPARING THE SAME Sichuan Huili Industry Co., Ltd. (CN) 2020-03-05 US disclosed
US-20200070485-A1 FILM FOR MEDICINE PACKAGING AND METHOD OF PREPARING THE SAME Sichuan Huili Industry Co., Ltd. (CN) 2020-03-05 US disclosed