SCHEMBL29068408

SCHEMBL29068408

O=Cc1ccnc(C(=O)O)c1.[LiH].[Rh]

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.53
ALDH1A1 P00352 4/20 0.53
KDM5A P29375 2/20 0.53
KDM3A Q9Y4C1 2/20 0.53
ASPH Q12797 2/20 0.53
KDM8 Q8N371 2/20 0.53
MAPT P10636 2/20 0.53
KDM6B O15054 1/20 0.53
TET3 O43151 1/20 0.53
KDM4A O75164 1/20 0.53
BBOX1 O75936 1/20 0.53
KDM5C P41229 1/20 0.53
KDM4D Q6B0I6 1/20 0.53
TET2 Q6N021 1/20 0.53
ALKBH5 Q6P6C2 1/20 0.53
KDM7A Q6ZMT4 1/20 0.53
TET1 Q8NFU7 1/20 0.53
EGLN2 Q96KS0 1/20 0.53
FTO Q9C0B1 1/20 0.53
EGLN1 Q9GZT9 1/20 0.53

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
SCHEMBL8922592 0.96 KDM4E (0.57) KDM4EALDH1A1KDM5AKDM3AASPH
SCHEMBL28745326 0.81 KDM4E (0.53) KDM4EALDH1A1KDM5AKDM3AASPH
SCHEMBL27791018 0.80 KDM4E (0.52) KDM4EALDH1A1KDM5AKDM3AASPH
SCHEMBL2558686 0.80 TRIM24 (0.59) KDM4EALDH1A1KDM5AKDM3AASPH
SCHEMBL31633475 0.79 KDM4E (0.55) KDM4EALDH1A1KDM5AKDM3AASPH
SCHEMBL21018215 0.79 ALDH1A1 (0.47) KDM4EALDH1A1KDM5AKDM3AASPH
SCHEMBL6568282 0.79 KDM4E (0.55) KDM4EALDH1A1KDM5AKDM3AASPH
SCHEMBL2563186 0.79 KMO (0.58) KDM4EALDH1A1KDM5AKDM3AASPH
SCHEMBL6611571 0.75 ALDH1A1 (0.49) KDM4EALDH1A1KDM3AMAPTKDM6B
SCHEMBL9000523 0.75 KDM4E (0.50) KDM4EALDH1A1KDM5AKDM3AASPH

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-111558395-B Bimetallic catalyst for methanol carbonylation reaction, and preparation method and application thereof 江苏索普化工股份有限公司 2023-09-08 CN disclosed