SCHEMBL8944559

SCHEMBL8944559

CC1(C)CC(OC(=O)NNC(=O)OC2CC(C)(C)N(OC3CCCCC3)C(C)(C)C2)CC(C)(C)N1OC1CCCCC1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.41
TSHR P16473 4/20 0.35
KMT2A Q03164 2/20 0.35
ALDH1A1 P00352 2/20 0.35
HSD17B10 Q99714 2/20 0.35
ALOX15 P16050 1/20 0.35
CYP3A4 P08684 2/20 0.34
CYP2C19 P33261 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
MEN1 O00255 1/20 0.34
CYP1A2 P05177 1/20 0.34
MAPT P10636 1/20 0.34
ESR1 P03372 1/20 0.34
NPC1 O15118 1/20 0.32
POLB P06746 1/20 0.32
RAB9A P51151 1/20 0.32
FAAH O00519 1/20 0.30
MGLL Q99685 1/20 0.30
GAA P10253 1/20 0.30

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
SCHEMBL10067197 0.89 TSHR (0.38) EPHX1TSHRKMT2AALDH1A1HSD17B10
SCHEMBL13412654 0.85 CYP2C19 (0.40) EPHX1TSHRKMT2AALDH1A1HSD17B10
SCHEMBL8462829 0.84 TSHR (0.49) EPHX1TSHRKMT2AALDH1A1HSD17B10
SCHEMBL10160344 0.84 EPHX1 (0.46) EPHX1TSHRGAA
Hydrochloric Acid SCHEMBL9337013 0.82 TSHR (0.35) EPHX1TSHRKMT2AALDH1A1HSD17B10
SCHEMBL580975 0.82 NAAA (0.45) EPHX1TSHRKMT2AALDH1A1HSD17B10
SCHEMBL9270235 0.82 TSHR (0.38) EPHX1TSHRKMT2AALDH1A1HSD17B10
SCHEMBL13474861 0.82 TSHR (0.35) EPHX1TSHRKMT2AALDH1A1HSD17B10
SCHEMBL9270239 0.82 TSHR (0.38) EPHX1TSHRKMT2AALDH1A1HSD17B10
SCHEMBL9334232 0.82 TSHR (0.35) EPHX1TSHRKMT2AALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5578731-A ASYMMETRICAL HYDRAZINE DERIVATIVE CIBA-GEIGY CORPORATION (US) 1996-11-26 US disclosed
US-5554754-A PHOTOSTABILIZERS CIBA-GEIGY CORPORATION (US) 1996-09-10 US disclosed
US-5470980-A Light stabilizers for polymers that can be grafted to polymers CIBA-GEIGY CORPORATION (US) 1995-11-28 US disclosed
EP-0647626-A1 Azadicarboxylic acid derivatives containing hindered amine moieties as polymer stabilisers CIBA-GEIGY AG (CH) 1995-04-12 EP disclosed
US-5380828-A Stabilization by being grafted onto a polymer CIBA-GEIGY CORPORATION (US) 1995-01-10 US disclosed