SCHEMBL29198809

SCHEMBL29198809

Ic1cc2c(cc1OCc1ccccc1)OCO2

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAOB P27338 9/20 0.59
TDP1 Q9NUW8 2/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
KMT2A Q03164 1/20 0.48
MAOA P21397 7/20 0.48
FFAR1 O14842 1/20 0.46
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
MAPT P10636 2/20 0.43
ALDH1A1 P00352 1/20 0.43
TP53 P04637 1/20 0.43
TSHR P16473 1/20 0.43
ATM Q13315 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HTR1A P08908 1/20 0.42
DRD2 P14416 1/20 0.42
MAPK1 P28482 1/20 0.41

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
SCHEMBL9789581 0.81 MAOB (0.59) MAOBTDP1L3MBTL1KMT2AMAOA
SCHEMBL7775193 0.81 MAOB (0.59) MAOBTDP1L3MBTL1KMT2AMAOA
SCHEMBL13854257 0.81 MAOB (0.59) MAOBTDP1L3MBTL1KMT2AMAOA
SCHEMBL20755877 0.81 FFAR1 (0.57) MAOBTDP1L3MBTL1FFAR1MAPT
SCHEMBL21366597 0.80 MAOB (0.57) MAOBTDP1L3MBTL1KMT2AMAOA
SCHEMBL21363788 0.78 MAOB (0.55) MAOBTDP1L3MBTL1KMT2AMAOA
SCHEMBL9293063 0.78 KMT2A (0.65) MAOBTDP1L3MBTL1KMT2AMAOA
SCHEMBL1316052 0.78 MAOB (0.58) MAOBTDP1L3MBTL1KMT2AMAOA
SCHEMBL21363756 0.77 MAOB (0.54) MAOBTDP1L3MBTL1KMT2AMAOA
SCHEMBL14552348 0.77 MAOB (0.54) MAOBTDP1L3MBTL1KMT2AMAOA

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-117069732-B Preparation method of benzo [ c ] phenanthridine natural product and derivative thereof 沈阳药科大学 2024-04-26 CN disclosed
CN-117069732-A Preparation method of benzo [ c ] phenanthridine natural product and derivative thereof 沈阳药科大学 2023-11-17 CN disclosed