SCHEMBL28544329

SCHEMBL28544329

NC(=O)NOC(=O)c1ccc(N)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.50
CYP1A2 P05177 2/20 0.50
CYP3A4 P08684 2/20 0.50
MAOA P21397 2/20 0.50
KMT2A Q03164 3/20 0.47
POLB P06746 2/20 0.47
ALDH1A1 P00352 2/20 0.47
MAPT P10636 2/20 0.47
PARP10 Q53GL7 1/20 0.47
MASP2 O00187 1/20 0.46
PLAU P00749 1/20 0.46
THPO P40225 1/20 0.46
F2 P00734 3/20 0.45
PRSS1 P07477 3/20 0.45
PRSS3 P35030 3/20 0.45
APEX1 P27695 2/20 0.45
PRSS2 P07478 2/20 0.45
TSHR P16473 2/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44

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
SCHEMBL27473771 0.91 ALDH1A1 (0.54) KMT2APOLBALDH1A1MAPTPARP10
SCHEMBL29192943 0.82 ALDH1A1 (0.58) LMNACYP1A2KMT2APOLBALDH1A1
SCHEMBL6269137 0.81 ALDH1A1 (0.70) LMNACYP3A4KMT2APOLBALDH1A1
SCHEMBL6682497 0.79 LMNA (0.55) LMNACYP1A2CYP3A4MAOAKMT2A
Biphenyl SCHEMBL8014588 0.76 ALDH1A1 (0.63) LMNACYP3A4KMT2APOLBALDH1A1
SCHEMBL27525096 0.76 LMNA (0.47) LMNACYP1A2CYP3A4MAOAKMT2A
SCHEMBL13479832 0.76 KMT2A (0.58) LMNACYP1A2CYP3A4MAOAKMT2A
SCHEMBL7555577 0.76 ALDH1A1 (0.52) KMT2APOLBALDH1A1MAPTPARP10
SCHEMBL42732 0.76 CA1 (0.64) LMNACYP1A2CYP3A4MAOAKMT2A
SCHEMBL6228872 0.75 LMNA (0.59) LMNACYP1A2CYP3A4MAOAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112704680-B Composition for preventing and/or treating organ fibrosis and application and preparation thereof 广东盛普生命科技有限公司 2022-08-02 CN disclosed
CN-112704680-A Composition for preventing and/or treating organ fibrosis and application and preparation thereof 广东盛普生命科技有限公司 2021-04-27 CN disclosed