SCHEMBL3627201

SCHEMBL3627201

CCc1ccc(-c2cc3cc4sc(-c5ccc(CC)cc5)cc4cc3s2)cc1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 8/20 0.46
ESR2 Q92731 8/20 0.46
IKBKB O14920 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.41
APP P05067 2/20 0.41
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
STK17B O94768 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
POLB P06746 1/20 0.37
GAA P10253 1/20 0.37
TP53 P04637 1/20 0.36
MAPT P10636 1/20 0.36

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
SCHEMBL13766429 0.84 APP (0.62) ESR1ESR2IKBKBSMN1; SMN2APP
SCHEMBL3144306 0.83 ESR1 (0.73) ESR1ESR2IKBKBAPPHDAC6
SCHEMBL20473171 0.81 MAPT (0.46) ESR1ESR2SMN1; SMN2APPNPC1
SCHEMBL3627359 0.80 KDM4E (0.47) ESR1SMN1; SMN2RAB9AGAATP53
SCHEMBL2756691 0.78 IKBKB (0.41) ESR1ESR2IKBKBSMN1; SMN2APP
SCHEMBL14985732 0.78 IKBKB (0.44) ESR1ESR2IKBKBSMN1; SMN2NPC1
SCHEMBL3621380 0.78 ESR1 (0.68) ESR1ESR2APPHDAC6
SCHEMBL26292185 0.77 ESR1 (0.44) ESR1ESR2IKBKBAPPSTK17B
SCHEMBL31357470 0.77 STK17B (0.44) IKBKBSMN1; SMN2NPC1RAB9ASTK17B
SCHEMBL26040038 0.76 ESR1 (0.66) ESR1ESR2APPHDAC6

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-2207218-B1 FIELD EFFECT TRANSISTOR NIPPON KAYAKU KK (JP) 2012-08-15 EP disclosed
EP-2207218-A1 FIELD EFFECT TRANSISTOR Nippon Kayaku Kabushiki Kaisha (JP) 2010-07-14 EP disclosed