SCHEMBL28995203

SCHEMBL28995203

CNC(=O)Cn1c(NC(=O)O)nc2ccccc21

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 8/20 0.56
SMN1; SMN2 Q16637 4/20 0.56
POLB P06746 1/20 0.56
NPSR1 Q6W5P4 4/20 0.55
KDM4E B2RXH2 3/20 0.55
CYP1A2 P05177 1/20 0.55
CYP2C9 P11712 1/20 0.55
CYP2C19 P33261 1/20 0.55
RAB9A P51151 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
HTT P42858 4/20 0.53
TSHR P16473 3/20 0.53
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
HIF1A Q16665 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
USP2 O75604 2/20 0.53
GSK3B P49841 1/20 0.52
MCHR1 Q99705 1/20 0.52
MMP2 P08253 1/20 0.51

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
SCHEMBL12497263 0.83 LMNA (0.69) LMNASMN1; SMN2POLBCYP1A2CYP2C9
SCHEMBL23566386 0.81 KDM4E (0.78) LMNASMN1; SMN2POLBNPSR1KDM4E
SCHEMBL23566367 0.80 KDM4E (0.59) LMNASMN1; SMN2POLBNPSR1KDM4E
SCHEMBL17824280 0.77 LMNA (0.61) LMNASMN1; SMN2POLBCYP1A2CYP2C9
SCHEMBL12501224 0.77 HDAC1 (0.56) LMNANPSR1L3MBTL1MMP2TP53
SCHEMBL3771751 0.76 RAB9A (0.74) LMNASMN1; SMN2POLBNPSR1KDM4E
SCHEMBL26619060 0.76 TSHR (0.51) LMNASMN1; SMN2POLBNPSR1KDM4E
SCHEMBL6325602 0.74 SMN1; SMN2 (0.70) SMN1; SMN2POLBNPSR1KDM4ECYP1A2
Hydrochloric Acid SCHEMBL30282138 0.74 KDM4E (0.61) LMNASMN1; SMN2POLBNPSR1KDM4E
Hydrochloric Acid SCHEMBL29205457 0.74 KDM4E (0.61) LMNASMN1; SMN2POLBNPSR1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113272363-B Silicone-organic copolymers, sealants including silicone-organic copolymers, and related methods 美国陶氏有机硅公司 2023-02-17 CN disclosed