SCHEMBL8898829

SCHEMBL8898829

C=CCC(C)(C(=O)c1ccc(N2CCN(C)CC2)cc1)N1CCOCC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.43
ALDH1A1 P00352 2/20 0.43
TSHR P16473 1/20 0.43
MAPK1 P28482 1/20 0.43
LMNA P02545 3/20 0.42
NPC1 O15118 3/20 0.42
RAB9A P51151 3/20 0.42
TP53 P04637 1/20 0.42
HDAC3 O15379 10/20 0.42
HDAC8 Q9BY41 10/20 0.42
HDAC4 P56524 2/20 0.41
HDAC1 Q13547 2/20 0.41
HDAC7 Q8WUI4 2/20 0.41
HDAC2 Q92769 2/20 0.41
HDAC10 Q969S8 2/20 0.41
HDAC11 Q96DB2 2/20 0.41
HDAC6 Q9UBN7 2/20 0.41
HDAC9 Q9UKV0 2/20 0.41
HDAC5 Q9UQL6 2/20 0.41
GSK3B P49841 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
SCHEMBL8898770 0.93 GSK3B (0.47) SMN1; SMN2ALDH1A1TSHRMAPK1LMNA
SCHEMBL8898370 0.93 NPC1 (0.46) SMN1; SMN2ALDH1A1LMNANPC1RAB9A
SCHEMBL8898865 0.91 ALDH1A1 (0.44) SMN1; SMN2ALDH1A1TSHRMAPK1LMNA
SCHEMBL8898854 0.84 MAPK1 (0.47) SMN1; SMN2ALDH1A1TSHRMAPK1LMNA
SCHEMBL8899547 0.84 SMN1; SMN2 (0.40) SMN1; SMN2ALDH1A1TSHRMAPK1LMNA
SCHEMBL8897565 0.83 ALDH1A1 (0.46) SMN1; SMN2ALDH1A1TSHRMAPK1LMNA
SCHEMBL8898884 0.83 ALDH1A1 (0.46) SMN1; SMN2ALDH1A1TSHRMAPK1LMNA
SCHEMBL8898821 0.83 ALDH1A1 (0.45) SMN1; SMN2ALDH1A1TSHRMAPK1LMNA
SCHEMBL8900086 0.82 HDAC6 (0.44) SMN1; SMN2ALDH1A1TSHRMAPK1LMNA
SCHEMBL8896884 0.81 ALDH1A1 (0.67) SMN1; SMN2ALDH1A1TSHRMAPK1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5629356-A PHOTOCURABLE COMPOSITION CONTAINING ETHYLENICALLY UNSATURATED PHOTOPOLYMERIZABLE COMPOUND AND THE AMINOACETOPHENONE CIBA GEIGY CORPORATION (US) 1997-05-13 US disclosed
US-5554663-A α-aminoacetophenones as photoinitiators CIBA-GEIGY CORPORATION (US) 1996-09-10 US disclosed
US-5534629-A PHOTOPOLYMERIZATION OF PIGMENTED SYSTEMS, INKS CIBA-GEIGY CORPORATION (US) 1996-07-09 US disclosed
EP-0284561-B1 ALPHA-AMINOACETOPHENONES AS PHOTO INITIATORS CIBA-GEIGY AG (CH) 1993-05-12 EP disclosed
US-5077402-A For photocuring pigmented systems; printing inks, lacquers CIBA-GEIGY CORPORATION (US) 1991-12-31 US disclosed
EP-0284561-A2 Alpha-aminoacetophenones as photo initiators CIBA-GEIGY AG (CH) 1988-09-28 EP disclosed