Marcanin A

Marcanin A

SCHEMBL29923975

Cc1cc(=O)[nH]c2c1C(=O)c1ccccc1C2=O

nearest known ligand 0.64

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.47
POLB P06746 2/20 0.47
PAX8 Q06710 2/20 0.47
APAF1 O14727 1/20 0.47
TNKS2 Q9H2K2 5/20 0.46
CYP1A2 P05177 3/20 0.46
CYP2C19 P33261 2/20 0.46
TTR P02766 1/20 0.45
CYP1A1 P04798 1/20 0.42
ALDH1A1 P00352 5/20 0.42
CYP3A4 P08684 3/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
TSHR P16473 2/20 0.42
ELANE P08246 2/20 0.42
NPC1 O15118 2/20 0.42
MAPK1 P28482 1/20 0.42
CASP3 P42574 1/20 0.42
HBB P68871 1/20 0.42
SENP7 Q9BQF6 1/20 0.42
SENP6 Q9GZR1 1/20 0.42

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
SCHEMBL30201452 0.93 TNKS2 (0.46) RAB9APOLBPAX8APAF1TNKS2
SCHEMBL14873867 0.81 CYP1A2 (0.41) TNKS2CYP1A2CYP2C19ALDH1A1SMN1; SMN2
SCHEMBL7818677 0.76 CYP1A2 (0.33) TNKS2CYP1A2CYP2C19ALDH1A1SMN1; SMN2
SCHEMBL30739431 0.72 ADORA2A (0.46) RAB9APOLBPAX8APAF1ALDH1A1
SCHEMBL30739423 0.72 ADORA1 (0.46) RAB9APOLBPAX8APAF1ALDH1A1
SCHEMBL20415202 0.72 TNKS2 (0.37) TNKS2CYP1A2CYP2C19ALDH1A1SMN1; SMN2
SCHEMBL7822034 0.71 KMT2A (0.45) ALDH1A1KDM4EHPGDKMT2A
SCHEMBL8920440 0.71 RAB9A (0.56) RAB9APOLBPAX8APAF1CYP1A2
SCHEMBL16380987 0.70 GRIN2D (0.37) TNKS2CYP1A2CYP2C19ALDH1A1SMN1; SMN2
SCHEMBL27353437 0.70 MEN1 (0.55) RAB9APOLBCYP1A2CYP2C19ALDH1A1

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-113226389-B Medical device with drug eluting coating on modified device surface 乐通公司 2022-11-08 CN disclosed