SCHEMBL9101203

SCHEMBL9101203

Cc1cc2ccccc2o1.O=C(O)c1cc2ccccc2o1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 1/20 0.61
NPC1 O15118 9/20 0.58
RAB9A P51151 9/20 0.58
TSHR P16473 3/20 0.58
MEN1 O00255 2/20 0.58
KMT2A Q03164 2/20 0.58
MAPK1 P28482 1/20 0.58
SMN1; SMN2 Q16637 6/20 0.56
ALDH1A1 P00352 6/20 0.56
HPGD P15428 5/20 0.56
MAPT P10636 5/20 0.56
TP53 P04637 5/20 0.55
PKM P14618 2/20 0.54
NFKB1 P19838 1/20 0.54
NFKB2 Q00653 1/20 0.54
RELA Q04206 1/20 0.54
CASP3 P42574 1/20 0.54
SENP8 Q96LD8 1/20 0.54
SENP7 Q9BQF6 1/20 0.54
SENP6 Q9GZR1 1/20 0.54

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
Benzene SCHEMBL28107977 0.89 FLT3 (0.74) FLT3NPC1RAB9ATSHRMEN1
SCHEMBL155789 0.89 FLT3 (0.74) FLT3NPC1RAB9ATSHRMEN1
SCHEMBL29460209 0.89 FLT3 (0.74) FLT3NPC1RAB9ATSHRMEN1
SCHEMBL27669244 0.88 FLT3 (0.71) FLT3NPC1RAB9ATSHRMEN1
Hydrochloric Acid SCHEMBL3611971 0.88 FLT3 (0.71) FLT3NPC1RAB9ATSHRMEN1
Methoxymethane SCHEMBL11265215 0.86 FLT3 (0.65) FLT3NPC1RAB9ATSHRMEN1
Acetic Acid SCHEMBL8595808 0.86 KDM4E (0.54) FLT3NPC1RAB9ATSHRMEN1
Cyanide SCHEMBL11197227 0.84 FLT3 (0.67) FLT3NPC1RAB9ATSHRMEN1
SCHEMBL7567706 0.83 FLT3 (0.65) FLT3NPC1RAB9ATSHRMEN1
Methyl Carbamate SCHEMBL28792447 0.82 FLT3 (0.59) FLT3NPC1RAB9ATSHRMEN1

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
EP-0707656-A1 BIOTECHNOLOGICAL PROCESS FOR PRODUCING ALCOHOLS, ALDEHYDES AND CARBOXYLIC ACIDS BASF AKTIENGESELLSCHAFT (DE) 1996-04-24 EP disclosed
WO-1995002061-A1 BIOTECHNOLOGICAL PROCESS FOR PRODUCING ALCOHOLS, ALDEHYDES AND CARBOXYLIC ACIDS BASF AKTIENGESELLSCHAFT (DE) 1995-01-19 WO disclosed