SCHEMBL11544822

SCHEMBL11544822

Cc1ccc2c(-c3ccccc3)c(Br)oc2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.42
KDM4E B2RXH2 5/20 0.42
ALDH1A1 P00352 4/20 0.42
ERAP1 Q9NZ08 1/20 0.42
HPGD P15428 3/20 0.42
MAPT P10636 3/20 0.42
TP53 P04637 1/20 0.42
CYP3A4 P08684 1/20 0.42
HSD17B10 Q99714 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41
NPC1 O15118 4/20 0.41
RAB9A P51151 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
POLB P06746 1/20 0.41
CASP3 P42574 1/20 0.41
SENP8 Q96LD8 1/20 0.41
SENP7 Q9BQF6 1/20 0.41
SENP6 Q9GZR1 1/20 0.41
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40

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
SCHEMBL11547910 0.87 L3MBTL1 (0.53) MAOBKDM4EALDH1A1HPGDMAPT
SCHEMBL16378927 0.81 KDM4E (0.50) MAOBKDM4EALDH1A1ERAP1HPGD
SCHEMBL11743676 0.80 ALDH1A1 (0.60) MAOBKDM4EALDH1A1HPGDMAPT
SCHEMBL11663639 0.78 CA1 (0.49) KDM4EALDH1A1HPGDMAPTTP53
SCHEMBL11745212 0.76 L3MBTL1 (0.47) KDM4EALDH1A1ERAP1HPGDMAPT
SCHEMBL29018225 0.74 ALDH1A1 (0.42) MAOBKDM4EALDH1A1ERAP1HPGD
SCHEMBL11547876 0.74 HNF4A (0.43) MAOBKDM4EALDH1A1ERAP1HPGD
SCHEMBL9917226 0.74 MAOB (0.49) MAOBKDM4EALDH1A1HPGDMAPT
SCHEMBL29926823 0.73 L3MBTL1 (0.47) MAOBKDM4EALDH1A1ERAP1HPGD
SCHEMBL28837162 0.73 L3MBTL1 (0.47) MAOBKDM4EALDH1A1ERAP1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4153619-A MICROBIOCIDES RIKER LABORATORIES, INC. (US) 1979-05-08 US disclosed
US-4141990-A BACTERICIDES, FUNGICIDES RIKER LABORATORIES, INC. (US) 1979-02-27 US disclosed
US-4124704-A ANTIMICROBIAL RIKER LABORATORIES, INC. (US) 1978-11-07 US disclosed