SCHEMBL6436055

SCHEMBL6436055

Oc1ccc2oc3ccccc3c(=S)c2c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 3/20 0.64
RAB9A P51151 4/20 0.45
KDM4E B2RXH2 4/20 0.45
MAPT P10636 3/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
ALDH1A1 P00352 2/20 0.45
LMNA P02545 1/20 0.45
ALOX15 P16050 1/20 0.45
HTT P42858 1/20 0.45
HSD17B10 Q99714 1/20 0.45
NPC1 O15118 3/20 0.45
CALM1 P0DP23 1/20 0.45
PKM P14618 1/20 0.45
FTO Q9C0B1 1/20 0.45
ALOX5 P09917 1/20 0.45
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
HPGD P15428 2/20 0.44
CYP3A4 P08684 2/20 0.44
CYP2C19 P33261 2/20 0.44

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
SCHEMBL9329739 0.89 MAOA (0.69) MAOAKDM4EMAPTSMN1; SMN2ALDH1A1
SCHEMBL905380 0.84 MAOA (0.72) MAOARAB9AKDM4EMAPTSMN1; SMN2
SCHEMBL195537 0.82 ALDH1A1 (0.56) MAOARAB9AKDM4EMAPTSMN1; SMN2
SCHEMBL29487286 0.82 ALDH1A1 (0.56) MAOARAB9AKDM4EMAPTSMN1; SMN2
SCHEMBL27434682 0.81 MAOA (0.68) MAOARAB9AKDM4EMAPTSMN1; SMN2
SCHEMBL11573807 0.78 TNKS (0.45) MAOARAB9AKDM4EMAPTSMN1; SMN2
SCHEMBL1258329 0.78 MAOB (0.50) MAOARAB9AKDM4EMAPTSMN1; SMN2
Xanthone SCHEMBL29025600 0.78 MAOA (1.00) MAOARAB9AKDM4EMAPTSMN1; SMN2
SCHEMBL11634806 0.78 GABRP (0.45) MAOARAB9AKDM4EMAPTSMN1; SMN2
SCHEMBL30599042 0.78 MAOA (1.00) MAOARAB9AKDM4EMAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1063975-B1 CROSSLINKABLE MACROMERS BEARING INITIATOR GROUPS SURMODICS INC (US) 2005-05-18 EP claimed
EP-0377191-B1 Radiation-sensitive ethylenically unsaturated copolymerisable compounds, and process for their preparation BASF AG (DE) 1994-03-23 EP disclosed
EP-0499836-A2 Carbonate and carbonyl-containing compounds, their preparation and applications BASF Aktiengesellschaft (DE) 1992-08-26 EP disclosed
EP-0377191-A2 Radiation-sensitive ethylenically unsaturated copolymerisable compounds, and process for their preparation BASF Aktiengesellschaft (DE) 1990-07-11 EP disclosed
EP-0377198-A2 Chloroformiates of aromatic ketones, and process for their preparation BASF Aktiengesellschaft (DE) 1990-07-11 EP disclosed
EP-0281941-A2 Coreactive photoinitiators CIBA-GEIGY AG (CH) 1988-09-14 EP disclosed
US-4404220-A INSECTIDES VELSICOL CHEMICAL CORPORATION (US) 1983-09-13 US disclosed
US-4299772-A INSECTICIDES VELSICOL CHEMICAL CORPORATION (US) 1981-11-10 US disclosed