SCHEMBL9315365

SCHEMBL9315365

CCCC(Cc1ccccc1)(C(=O)c1ccc(OC)c(OC)c1)N(C)C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 6/20 0.51
BCHE P06276 5/20 0.51
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
HPGD P15428 1/20 0.46
ALDH1A1 P00352 2/20 0.44
MAPT P10636 2/20 0.44
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA4 P22748 1/20 0.43
CA6 P23280 1/20 0.43
CA7 P43166 1/20 0.43
TPMT P51580 1/20 0.43
CA9 Q16790 1/20 0.43
CA14 Q9ULX7 1/20 0.43
TNFRSF1A P19438 1/20 0.43
LMNA P02545 1/20 0.43
KDM4E B2RXH2 1/20 0.43

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
SCHEMBL29421022 0.91 ACHE (0.53) ACHEBCHENPC1RAB9ASMN1; SMN2
SCHEMBL480430 0.91 ACHE (0.53) ACHEBCHENPC1RAB9ASMN1; SMN2
SCHEMBL21706301 0.81 ACHE (0.45) ACHEBCHENPC1RAB9ASMN1; SMN2
SCHEMBL4652464 0.81 ACHE (0.47) ACHEBCHESMN1; SMN2HPGDALDH1A1
SCHEMBL8176376 0.81 HPGD (0.47) ACHEBCHENPC1RAB9ASMN1; SMN2
SCHEMBL8776056 0.81 ACHE (0.42) ACHEBCHENPC1RAB9ASMN1; SMN2
SCHEMBL9316355 0.80 CTNNB1 (0.50) ACHEBCHEALDH1A1MAPTCA12
SCHEMBL8175821 0.80 HPGD (0.46) ACHEBCHENPC1RAB9ASMN1; SMN2
SCHEMBL8179111 0.80 HPGD (0.46) ACHEBCHENPC1RAB9ASMN1; SMN2
SCHEMBL17514057 0.79 BCHE (0.50) ACHEBCHESMN1; SMN2ALDH1A1MAPT

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-5306600-A Oxygen-containing titanocenes, and the use thereof CIBA-GEIGY CORPORATION (US) 1994-04-26 US disclosed
US-5192642-A Photoinitiators for addition photopolymerization, coatings CIBA-GEIGY CORPORATION (US) 1993-03-09 US disclosed
US-5068371-A Photoinitiators for polymerization CIBA-GEIGY CORPORATION (US) 1991-11-26 US disclosed