SCHEMBL8461537

SCHEMBL8461537

CC[CH]c1cc(C)cc(C)c1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.38
TSHR P16473 1/20 0.38
TP53 P04637 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CYP2A6 P11509 1/20 0.32
ACHE P22303 1/20 0.32
NPC1 O15118 1/20 0.31
CASP3 P42574 1/20 0.31
SENP8 Q96LD8 1/20 0.31
SENP7 Q9BQF6 1/20 0.31
SENP6 Q9GZR1 1/20 0.31
TPMT P51580 1/20 0.31
HTT P42858 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
NOS3 P29474 1/20 0.30
NOS2 P35228 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
SCHEMBL1611086 0.74 TUBB1 (0.39)
SCHEMBL16390114 0.74 CYP19A1 (0.42) ALDH1A1TSHR
SCHEMBL1611151 0.74 TP53 (0.58) ALDH1A1TP53TDP1ACHENPC1
SCHEMBL280640 0.73 CYP2A6 (0.52) ALDH1A1TSHRTDP1CYP2A6TPMT
SCHEMBL5253489 0.71 ALDH1A1 (0.44) ALDH1A1TSHRTP53TDP1CYP2A6
SCHEMBL3692946 0.71 ALDH1A1 (0.44) ALDH1A1TSHRTP53TDP1ACHE
SCHEMBL3692947 0.71 ALDH1A1 (0.44) ALDH1A1TSHRTP53TDP1ACHE
Hydrochloric Acid SCHEMBL28065211 0.71 CYP2A6 (0.50) ALDH1A1TSHRTDP1CYP2A6TPMT
SCHEMBL310519 0.71 CYP2A6 (0.57) ALDH1A1TDP1CYP2A6ACHENPC1
SCHEMBL10823080 0.70 CYP3A4 (0.44) ALDH1A1TSHR

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
EP-0634449-B1 Polyether with sterically hindered amine side chains as stabilizing agents CIBA GEIGY AG (CH) 1999-09-01 EP disclosed
US-5719257-A OBTAINED BY ANIONIC POLYMERIZATION OF DERIVATIVES OF 2,2,6,6-TETRAMETHYL-4-/2,3-EPOXYPROPOXY/PIPERIDINE CIBA SPECIALTY CHEMICALS CORPORATION (US) 1998-02-17 US disclosed
US-5616637-A PHOTOSTABILITY; OXIDTION AND HEAT RESISTANT CIBA-GEIGY CORPORATION (US) 1997-04-01 US disclosed
US-5521282-A FROM 4-/2,3-EPOXYPROPOXY/-2,2,6,6-TETRAMETHYLPIPERIDINE CIBA-GEIGY CORPORATION (US) 1996-05-28 US disclosed
EP-0634449-A2 Polyether with sterically hindered amine side chains as stabilizing agents CIBA-GEIGY AG (CH) 1995-01-18 EP disclosed