SCHEMBL8899765

SCHEMBL8899765

C=CCC(CC)(C(=O)c1ccc(Sc2ccc(C)cc2)cc1)N1CCOCC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 4/20 0.46
ALDH1A1 P00352 4/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
TSHR P16473 2/20 0.46
RAB9A P51151 3/20 0.40
TP53 P04637 2/20 0.40
FKBP1A P62942 1/20 0.40
CYP2D6 P10635 1/20 0.38
LMNA P02545 2/20 0.37
MEN1 O00255 2/20 0.35
CYP2C19 P33261 2/20 0.35
KMT2A Q03164 2/20 0.35
CYP3A4 P08684 1/20 0.35
MAPT P10636 2/20 0.35
MGLL Q99685 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
SLC6A2 P23975 1/20 0.34
SLC6A3 Q01959 1/20 0.34
NPC1 O15118 1/20 0.34
PKM P14618 1/20 0.34

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
SCHEMBL8899759 0.88 ALDH1A1 (0.60) MAPK1ALDH1A1SMN1; SMN2TSHRRAB9A
SCHEMBL8897530 0.87 SMN1; SMN2 (0.47) MAPK1ALDH1A1SMN1; SMN2TSHRRAB9A
SCHEMBL8898520 0.86 ALDH1A1 (0.40) MAPK1ALDH1A1SMN1; SMN2TSHRCYP2D6
SCHEMBL8900827 0.86 SMN1; SMN2 (0.46) MAPK1ALDH1A1SMN1; SMN2TSHRRAB9A
SCHEMBL8898861 0.84 SMN1; SMN2 (0.45) MAPK1ALDH1A1SMN1; SMN2TSHRRAB9A
SCHEMBL8900168 0.83 NPC1 (0.42) MAPK1ALDH1A1SMN1; SMN2TSHRRAB9A
SCHEMBL3426330 0.83 ALDH1A1 (0.41) MAPK1ALDH1A1SMN1; SMN2TSHRRAB9A
SCHEMBL8900852 0.83 GSK3B (0.45) MAPK1ALDH1A1SMN1; SMN2TSHRRAB9A
SCHEMBL8897848 0.82 ALDH1A1 (0.64) MAPK1ALDH1A1SMN1; SMN2TSHRRAB9A
SCHEMBL4424512 0.81 ALDH1A1 (0.40) MAPK1ALDH1A1SMN1; SMN2TSHRRAB9A

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