SCHEMBL7723992

SCHEMBL7723992

Oc1ccc2c(c1)c1c(O)cccc1n2Cc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SRC P12931 2/20 0.53
CYP19A1 P11511 1/20 0.51
MEN1 O00255 4/20 0.50
KMT2A Q03164 4/20 0.50
MAPT P10636 3/20 0.50
ALDH1A1 P00352 3/20 0.50
GAA P10253 2/20 0.50
PKM P14618 2/20 0.50
KDM4E B2RXH2 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
PLA2G2A P14555 7/20 0.49
LMNA P02545 1/20 0.48
P2RX4 Q99571 1/20 0.46
POLB P06746 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
MAPK1 P28482 1/20 0.43
PRKDC P78527 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
SCHEMBL6924327 0.87 SRC (0.51) SRCCYP19A1MEN1KMT2AMAPT
SCHEMBL6921173 0.86 CYP19A1 (0.65) SRCCYP19A1MEN1KMT2AMAPT
SCHEMBL6923659 0.86 KMT2A (0.51) SRCCYP19A1MEN1KMT2AMAPT
SCHEMBL6923669 0.86 SRC (0.50) SRCCYP19A1MEN1KMT2AMAPT
SCHEMBL6920467 0.83 PLA2G2A (0.55) KMT2APLA2G2AP2RX4MAPK1
SCHEMBL6984365 0.82 PLA2G2A (0.55) SRCCYP19A1MEN1KMT2AMAPT
Pyridine SCHEMBL7506032 0.80 SRC (0.44) SRCCYP19A1MEN1KMT2AMAPT
SCHEMBL6921048 0.79 HDAC1 (0.43) SRCMEN1KMT2AMAPTALDH1A1
SCHEMBL6924122 0.76 PLA2G2A (0.46) SRCCYP19A1MEN1KMT2AMAPT
SCHEMBL6926577 0.76 MAPT (0.43) MEN1KMT2AMAPTALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6407261-B1 OXIDIZING THE CORRESPONDING KETONE COMPOUND BY HEATING WITH A SUKFINATING COMPOUND ELI LILLY AND COMPANY 2002-06-18 US disclosed
EP-1071661-A4 PROCESS FOR PREPARING 4-HYDROXY INDOLE, INDAZOLE AND CARBAZOLE COMPOUNDS LILLY CO ELI (US) 2001-08-22 EP disclosed
EP-1071661-A1 PROCESS FOR PREPARING 4-HYDROXY INDOLE, INDAZOLE AND CARBAZOLE COMPOUNDS ELI LILLY AND COMPANY (US) 2001-01-31 EP disclosed
WO-1999054295-A1 PROCESS FOR PREPARING 4-HYDROXY INDOLE, INDAZOLE AND CARBAZOLE COMPOUNDS ELI LILLY AND COMPANY (US) 1999-10-28 WO disclosed