SCHEMBL11543780

SCHEMBL11543780

Cc1c(CC(=O)O)oc2ccc(Cc3ccccc3)cc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 6/20 0.46
MTNR1B P49286 5/20 0.46
PTGDR2 Q9Y5Y4 1/20 0.44
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
GAA P10253 2/20 0.40
KDM4E B2RXH2 1/20 0.40
GLA P06280 1/20 0.40
HSD17B3 P37058 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
ERAP1 Q9NZ08 1/20 0.40
LMNA P02545 1/20 0.40
ACP1 P24666 1/20 0.39
POLB P06746 1/20 0.39
HNF4A P41235 1/20 0.39
PTPN1 P18031 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
PLA2G10 O15496 1/20 0.39
PLA2G2A P14555 1/20 0.39

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
SCHEMBL11544580 0.81 L3MBTL1 (0.45) GAAKDM4ELMNAACP1POLB
SCHEMBL11542270 0.80 MAPT (0.54) MEN1KMT2AGAAKDM4ENPC1
SCHEMBL7030133 0.79 KCNH2 (0.48) MTNR1AMTNR1BMEN1KMT2AKDM4E
SCHEMBL11542872 0.79 RAB9A (0.46) PTGDR2MEN1KMT2AGAAKDM4E
SCHEMBL11545978 0.77 MCL1 (0.61) PTGDR2MEN1KMT2AKDM4ENPC1
SCHEMBL5972977 0.77 HSD17B10 (0.43) MTNR1AMTNR1BMEN1KMT2AGAA
SCHEMBL25707033 0.76 KDM4E (0.40) MTNR1AMTNR1BMEN1KMT2AGAA
SCHEMBL11544887 0.75 KDM4E (0.52) MEN1KMT2AGAAKDM4EPOLB
SCHEMBL11543638 0.75 PON1 (0.45) KDM4E
SCHEMBL6543877 0.74 HSD17B10 (0.49) MEN1KMT2AGAAKDM4ELMNA

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-4172145-A ANALGESICS, ANTIPYRETICS KYOWA HAKKO KOGYO KABUSHIKI KAISHA (JP) 1979-10-23 US claimed
US-4126625-A ANTIPHLOGISTIC, ANALGESIC KYOWA HAKKO KOGYO KABUSHIKI KAISHA (JP) 1978-11-21 US claimed
US-4172145-A ANALGESICS, ANTIPYRETICS KYOWA HAKKO KOGYO KABUSHIKI KAISHA (JP) 1979-10-23 US disclosed
US-4126625-A ANTIPHLOGISTIC, ANALGESIC KYOWA HAKKO KOGYO KABUSHIKI KAISHA (JP) 1978-11-21 US disclosed